smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@@H+](Cc1cccc(OCC[C@@H]2CCCCN2C(=O)C[NH+]2CCCCC2)c1)Cc1cccc2cccnc21	ZINC000012159383	1071236729	/nfs/dbraw/zinc/23/67/29/1071236729.db2.gz	WOUUPFRMPVKLJF-LJAQVGFWSA-N	2	1	514.714	5.503	50	0		KKAAMP
Cc1cc(C(C)(C)c2cc(C)c(NC(=O)C[NH+]3CCCC3)c(C)c2)cc(C)c1NC(=O)C[NH+]1CCCC1	ZINC000015745877	553536030	/nfs/dbraw/zinc/53/60/30/553536030.db2.gz	MWZXRVPXPBMGAC-UHFFFAOYSA-N	2	1	504.719	5.315	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CC[NH+]1C)Oc1cc3c(cc1OC)CC[N@H+](C)[C@@H]3C2	ZINC000070665313	553596097	/nfs/dbraw/zinc/59/60/97/553596097.db2.gz	CASHVZNATRNXDE-IHLOFXLRSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CC[N@@H+]1C)Oc1cc3c(cc1OC)CC[NH+](C)[C@@H]3C2	ZINC000070665313	553596098	/nfs/dbraw/zinc/59/60/98/553596098.db2.gz	CASHVZNATRNXDE-IHLOFXLRSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CC[N@H+]1C)Oc1cc3c(cc1OC)CC[NH+](C)[C@@H]3C2	ZINC000070665313	553596099	/nfs/dbraw/zinc/59/60/99/553596099.db2.gz	CASHVZNATRNXDE-IHLOFXLRSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@@H+](C)[C@H]4C2)CC[NH+]1C	ZINC000085977441	553692497	/nfs/dbraw/zinc/69/24/97/553692497.db2.gz	QAFGBLDGRLFICB-URLMMPGGSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@H+](C)[C@H]4C2)CC[NH+]1C	ZINC000085977441	553692500	/nfs/dbraw/zinc/69/25/00/553692500.db2.gz	QAFGBLDGRLFICB-URLMMPGGSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@H]4C2)CC[N@H+]1C	ZINC000085977441	553692503	/nfs/dbraw/zinc/69/25/03/553692503.db2.gz	QAFGBLDGRLFICB-URLMMPGGSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@H]4C2)CC[N@@H+]1C	ZINC000085977441	553692505	/nfs/dbraw/zinc/69/25/05/553692505.db2.gz	QAFGBLDGRLFICB-URLMMPGGSA-N	2	1	638.761	6.868	50	0		KKAAMP
Cc1cc([C@@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716780	553995607	/nfs/dbraw/zinc/99/56/07/553995607.db2.gz	QOWNPVISDLPHGN-IZLXSDGUSA-N	2	1	503.637	5.223	50	0		KKAAMP
Cc1cc([C@@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716780	553995610	/nfs/dbraw/zinc/99/56/10/553995610.db2.gz	QOWNPVISDLPHGN-IZLXSDGUSA-N	2	1	503.637	5.223	50	0		KKAAMP
CC[NH+]1CCN(c2c(C[N@H+](Cc3ccc(C(C)C)cc3)CC(C)C)c(C)nn2-c2ccc(F)cc2)CC1	ZINC000034836376	554020520	/nfs/dbraw/zinc/02/05/20/554020520.db2.gz	VFRUBCBEVOFWPN-UHFFFAOYSA-N	2	1	505.726	6.243	50	0		KKAAMP
Cc1cc(C)nc(S[C@H]2C[C@@H](C(=O)N3CC[NH+](C4C5CC6CC(C5)CC4C6)CC3)[N@@H+](CC3CCCCC3)C2)n1	ZINC000102031481	554867848	/nfs/dbraw/zinc/86/78/48/554867848.db2.gz	FQTKPTHECXOANK-VTEGQJLWSA-N	2	1	551.845	5.178	50	0		KKAAMP
CC[N@H+]1CCC[C@H]1CNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000102406052	554920886	/nfs/dbraw/zinc/92/08/86/554920886.db2.gz	LTPNREFXLJNFGW-WTGSTYHVSA-N	2	1	538.736	5.006	50	0		KKAAMP
CC[NH+]1CCC[C@H]1CNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000102406052	554920887	/nfs/dbraw/zinc/92/08/87/554920887.db2.gz	LTPNREFXLJNFGW-WTGSTYHVSA-N	2	1	538.736	5.006	50	0		KKAAMP
CC[NH+]1CCC[C@H]1CNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000102406052	554920890	/nfs/dbraw/zinc/92/08/90/554920890.db2.gz	LTPNREFXLJNFGW-WTGSTYHVSA-N	2	1	538.736	5.006	50	0		KKAAMP
COc1ccc(S[C@H]2C[C@@H](C(=O)N3CC[NH+](C4C5CC6CC(C5)CC4C6)CC3)[N@H+](Cc3ccc(OC)c(C)c3)C2)cc1	ZINC000102524807	554951674	/nfs/dbraw/zinc/95/16/74/554951674.db2.gz	KUACFDRJIHBCCM-JVUXQOOBSA-N	2	1	589.846	5.716	50	0		KKAAMP
COc1ccc(S[C@H]2C[C@@H](C(=O)N3CC[NH+](C4C5CC6CC(C5)CC4C6)CC3)[N@@H+](Cc3ccc(OC)c(C)c3)C2)cc1	ZINC000102524807	554951676	/nfs/dbraw/zinc/95/16/76/554951676.db2.gz	KUACFDRJIHBCCM-JVUXQOOBSA-N	2	1	589.846	5.716	50	0		KKAAMP
Cc1oc(-c2cccc(Cl)c2)nc1C[NH+]1CCC(C(=O)NCC[N@@H+](Cc2ccccc2)C(C)C)CC1	ZINC000009731842	553302698	/nfs/dbraw/zinc/30/26/98/553302698.db2.gz	FMHXOCXMXICYSD-UHFFFAOYSA-N	2	1	509.094	5.542	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000073331412	553653197	/nfs/dbraw/zinc/65/31/97/553653197.db2.gz	HGNHIFJNOKGSKI-FQLXRVMXSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000073331412	553653202	/nfs/dbraw/zinc/65/32/02/553653202.db2.gz	HGNHIFJNOKGSKI-FQLXRVMXSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000073331412	553653206	/nfs/dbraw/zinc/65/32/06/553653206.db2.gz	HGNHIFJNOKGSKI-FQLXRVMXSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CC[NH+]1C)Oc1cc3c(cc1OC)CC[N@H+](C)[C@H]3C2	ZINC000030726958	553855405	/nfs/dbraw/zinc/85/54/05/553855405.db2.gz	CASHVZNATRNXDE-KYJUHHDHSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CC[N@H+]1C)Oc1cc3c(cc1OC)CC[NH+](C)[C@H]3C2	ZINC000030726958	553855412	/nfs/dbraw/zinc/85/54/12/553855412.db2.gz	CASHVZNATRNXDE-KYJUHHDHSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CC[N@@H+]1C)Oc1cc3c(cc1OC)CC[NH+](C)[C@H]3C2	ZINC000030726958	553855408	/nfs/dbraw/zinc/85/54/08/553855408.db2.gz	CASHVZNATRNXDE-KYJUHHDHSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
Cc1cc([C@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716819	553995698	/nfs/dbraw/zinc/99/56/98/553995698.db2.gz	UXUMWYGVNIKARA-WUFINQPMSA-N	2	1	520.092	5.738	50	0		KKAAMP
Cc1cc([C@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716819	553995700	/nfs/dbraw/zinc/99/57/00/553995700.db2.gz	UXUMWYGVNIKARA-WUFINQPMSA-N	2	1	520.092	5.738	50	0		KKAAMP
[NH3+][C@H](c1ccccc1)[C@H](c1ccccc1)[PH+]1Cc2ccc3ccccc3c2-c2c(ccc3ccccc32)C1	ZINC000098072752	554176574	/nfs/dbraw/zinc/17/65/74/554176574.db2.gz	YHBAPPMVVCHAQC-XDSPJLLDSA-N	2	1	507.617	9.597	50	0		KKAAMP
Cc1ccc(C)c(C[N@H+]2C[C@@H](Sc3nccc(C)n3)C[C@H]2C(=O)N2CC[NH+](C3C4CC5CC(C4)CC3C5)CC2)c1	ZINC000101864107	554844841	/nfs/dbraw/zinc/84/48/41/554844841.db2.gz	MRQLJCFBFBCLIS-CRNNKKFJSA-N	2	1	559.824	5.106	50	0		KKAAMP
COc1ccccc1N1CCN(C(=O)CC[C@H]2C[N@@H+](CC(c3ccccc3)c3ccccc3)CC[C@H]2[NH+](C)C)CC1	ZINC000102639129	554990567	/nfs/dbraw/zinc/99/05/67/554990567.db2.gz	OZQSGMPTXTXKBE-XDFJSJKPSA-N	2	1	554.779	5.208	50	0		KKAAMP
c1ccc(C[Si](Cc2ccccc2)(Cc2ccccc2)[NH+]2CCC[N@H+]([Si](Cc3ccccc3)(Cc3ccccc3)Cc3ccccc3)CC2)cc1	ZINC000169817270	1071133059	/nfs/dbraw/zinc/13/30/59/1071133059.db2.gz	HFCXHMDARKAUQP-UHFFFAOYSA-N	2	1	701.119	9.577	50	0		KKAAMP
c1ccc(CC[N@@H+]2[C@@H](c3ccccc3)[C@@H](c3ccccc3)[C@@H]([NH2+]Cc3ccccc3)C[C@H]2c2ccccc2)cc1	ZINC000009347631	553244372	/nfs/dbraw/zinc/24/43/72/553244372.db2.gz	MTFXVXUBNOYWNP-ZQWQDMLBSA-N	2	1	522.736	8.360	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000100758580	554467475	/nfs/dbraw/zinc/46/74/75/554467475.db2.gz	DFOCUWZXJBAUSQ-WDYNHAJCSA-N	2	1	608.735	6.859	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000100758580	554467477	/nfs/dbraw/zinc/46/74/77/554467477.db2.gz	DFOCUWZXJBAUSQ-WDYNHAJCSA-N	2	1	608.735	6.859	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000100758580	554467479	/nfs/dbraw/zinc/46/74/79/554467479.db2.gz	DFOCUWZXJBAUSQ-WDYNHAJCSA-N	2	1	608.735	6.859	50	0		KKAAMP
O=C(NCCc1ccccc1F)[C@@H]1C[C@H]([NH2+]C2CC[NH+](CCc3ccccc3)CC2)CN1Cc1cccc(Cl)c1	ZINC000299798253	1071049646	/nfs/dbraw/zinc/04/96/46/1071049646.db2.gz	QTNZDSQJMPYIOQ-CDZUIXILSA-N	2	1	563.161	5.078	50	0		KKAAMP
C[N@@H+](Cc1cccc(OCC[C@H]2CCCCN2C(=O)C[NH+]2CCCCC2)c1)Cc1cccc2cccnc21	ZINC000012159389	1071237552	/nfs/dbraw/zinc/23/75/52/1071237552.db2.gz	WOUUPFRMPVKLJF-GDLZYMKVSA-N	2	1	514.714	5.503	50	0		KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(OCOc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CC[NH+]4C)cc3)cc1)[N@@H+](C)CC2	ZINC000070664881	553595230	/nfs/dbraw/zinc/59/52/30/553595230.db2.gz	KSGGQJQFYBWKMO-HJWAMQHWSA-N	2	1	638.805	6.680	50	0	biogenic	KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(OCOc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CC[N@H+]4C)cc3)cc1)[NH+](C)CC2	ZINC000070664881	553595233	/nfs/dbraw/zinc/59/52/33/553595233.db2.gz	KSGGQJQFYBWKMO-HJWAMQHWSA-N	2	1	638.805	6.680	50	0	biogenic	KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(OCOc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CC[N@@H+]4C)cc3)cc1)[NH+](C)CC2	ZINC000070664881	553595237	/nfs/dbraw/zinc/59/52/37/553595237.db2.gz	KSGGQJQFYBWKMO-HJWAMQHWSA-N	2	1	638.805	6.680	50	0	biogenic	KKAAMP
COc1cc2c(cc1O)CC[N@@H+](C)[C@@H]2Cc1ccc(O)c(Oc2ccc(C[C@@H]3c4cc(OC)c(OC)cc4CC[NH+]3C)cc2)c1	ZINC000085492190	553682527	/nfs/dbraw/zinc/68/25/27/553682527.db2.gz	OMFKIOLXDGQKCF-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c(cc1O)CC[NH+](C)[C@@H]2Cc1ccc(O)c(Oc2ccc(C[C@@H]3c4cc(OC)c(OC)cc4CC[N@H+]3C)cc2)c1	ZINC000085492190	553682529	/nfs/dbraw/zinc/68/25/29/553682529.db2.gz	OMFKIOLXDGQKCF-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c(cc1O)CC[NH+](C)[C@@H]2Cc1ccc(O)c(Oc2ccc(C[C@@H]3c4cc(OC)c(OC)cc4CC[N@@H+]3C)cc2)c1	ZINC000085492190	553682531	/nfs/dbraw/zinc/68/25/31/553682531.db2.gz	OMFKIOLXDGQKCF-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[N@H+](C)CC3	ZINC000040163546	554282792	/nfs/dbraw/zinc/28/27/92/554282792.db2.gz	FUZMQNZACIFDBL-XZWHSSHBSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[NH+](C)CC3	ZINC000040163546	554282796	/nfs/dbraw/zinc/28/27/96/554282796.db2.gz	FUZMQNZACIFDBL-XZWHSSHBSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[N@@H+](C)CC3	ZINC000040163546	554282794	/nfs/dbraw/zinc/28/27/94/554282794.db2.gz	FUZMQNZACIFDBL-XZWHSSHBSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[NH+](C)CC3	ZINC000040163546	554282798	/nfs/dbraw/zinc/28/27/98/554282798.db2.gz	FUZMQNZACIFDBL-XZWHSSHBSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000042850970	554296767	/nfs/dbraw/zinc/29/67/67/554296767.db2.gz	HGNHIFJNOKGSKI-VMPREFPWSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000042850970	554296771	/nfs/dbraw/zinc/29/67/71/554296771.db2.gz	HGNHIFJNOKGSKI-VMPREFPWSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000042850970	554296773	/nfs/dbraw/zinc/29/67/73/554296773.db2.gz	HGNHIFJNOKGSKI-VMPREFPWSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
C[C@@H](CNC(=O)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1)NC(=O)c1ccc(C[NH+]2CCc3ccccc3C2)cc1	ZINC000102034440	554868823	/nfs/dbraw/zinc/86/88/23/554868823.db2.gz	VWYBOQZLIDFHCH-MHZLTWQESA-N	2	1	572.753	5.352	50	0		KKAAMP
C[C@@H](CNC(=O)c1ccc(C[NH+]2CCc3ccccc3C2)cc1)NC(=O)c1ccc(C[N@@H+]2CCc3ccccc3C2)cc1	ZINC000102034440	554868826	/nfs/dbraw/zinc/86/88/26/554868826.db2.gz	VWYBOQZLIDFHCH-MHZLTWQESA-N	2	1	572.753	5.352	50	0		KKAAMP
C[C@@H](CNC(=O)c1ccc(C[NH+]2CCc3ccccc3C2)cc1)NC(=O)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1	ZINC000102034440	554868829	/nfs/dbraw/zinc/86/88/29/554868829.db2.gz	VWYBOQZLIDFHCH-MHZLTWQESA-N	2	1	572.753	5.352	50	0		KKAAMP
COc1ccc(S[C@H]2C[C@@H](C(=O)N3CC[NH+](C4C5CC6CC(C5)CC4C6)CC3)[N@@H+](Cc3ccc4ccccc4c3)C2)cc1	ZINC000102123776	554884378	/nfs/dbraw/zinc/88/43/78/554884378.db2.gz	VMCAVGZEJDNWLP-HIDUATBNSA-N	2	1	595.853	6.553	50	0		KKAAMP
CC[N@H+]1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000102406049	554920922	/nfs/dbraw/zinc/92/09/22/554920922.db2.gz	LTPNREFXLJNFGW-XAGDYJCDSA-N	2	1	538.736	5.006	50	0		KKAAMP
CC[NH+]1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000102406049	554920924	/nfs/dbraw/zinc/92/09/24/554920924.db2.gz	LTPNREFXLJNFGW-XAGDYJCDSA-N	2	1	538.736	5.006	50	0		KKAAMP
CC[NH+]1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H](C(=O)Nc2ccc3c(c2)CCC3)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000102406049	554920925	/nfs/dbraw/zinc/92/09/25/554920925.db2.gz	LTPNREFXLJNFGW-XAGDYJCDSA-N	2	1	538.736	5.006	50	0		KKAAMP
C[N@H+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000102432684	554927305	/nfs/dbraw/zinc/92/73/05/554927305.db2.gz	WRQBVIWRODFOBK-WIDNXDAUSA-N	2	1	553.669	5.976	50	0		KKAAMP
C[NH+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000102432684	554927308	/nfs/dbraw/zinc/92/73/08/554927308.db2.gz	WRQBVIWRODFOBK-WIDNXDAUSA-N	2	1	553.669	5.976	50	0		KKAAMP
C[NH+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000102432684	554927310	/nfs/dbraw/zinc/92/73/10/554927310.db2.gz	WRQBVIWRODFOBK-WIDNXDAUSA-N	2	1	553.669	5.976	50	0		KKAAMP
COc1ccccc1N1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CCC(=O)NCc2ccccc2Cl)CC1	ZINC000299759611	572134872	/nfs/dbraw/zinc/13/48/72/572134872.db2.gz	NLPJWDAPDLOKGC-MFMCTBQISA-N	2	1	561.170	5.458	50	0		KKAAMP
COc1ccccc1N1CC[NH+]([C@@H]2CCN(Cc3ccccc3)C[C@@H]2CCC(=O)NCc2ccccc2Cl)CC1	ZINC000299759611	572134876	/nfs/dbraw/zinc/13/48/76/572134876.db2.gz	NLPJWDAPDLOKGC-MFMCTBQISA-N	2	1	561.170	5.458	50	0		KKAAMP
COc1cc2c(cc1OC)C1(CCCC1)C[NH+](CCCCC[N@H+]1Cc3cc(OC)c(OC)cc3C3(CCCC3)C1)C2	ZINC000001835168	551712133	/nfs/dbraw/zinc/71/21/33/551712133.db2.gz	YJKADYKKKPYTJV-UHFFFAOYSA-N	2	1	562.795	6.846	50	0	biogenic	KKAAMP
C[C@@H]1CCCC[NH+]1CCCNC(=O)Nc1ccc(Cc2ccc(NC(=O)NCCC[N@@H+]3CCCC[C@@H]3C)cc2)cc1	ZINC000005648403	552505929	/nfs/dbraw/zinc/50/59/29/552505929.db2.gz	KVSODEOZJBNRSP-MKPDMIMOSA-N	2	1	562.803	6.049	50	0		KKAAMP
C[C@@H]1CCCC[N@H+]1CCCNC(=O)Nc1ccc(Cc2ccc(NC(=O)NCCC[NH+]3CCCC[C@@H]3C)cc2)cc1	ZINC000005648403	552505930	/nfs/dbraw/zinc/50/59/30/552505930.db2.gz	KVSODEOZJBNRSP-MKPDMIMOSA-N	2	1	562.803	6.049	50	0		KKAAMP
C[C@@H]1CCCC[N@@H+]1CCCNC(=O)Nc1ccc(Cc2ccc(NC(=O)NCCC[NH+]3CCCC[C@@H]3C)cc2)cc1	ZINC000005648403	552505933	/nfs/dbraw/zinc/50/59/33/552505933.db2.gz	KVSODEOZJBNRSP-MKPDMIMOSA-N	2	1	562.803	6.049	50	0		KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(OCOc3ccc(C[C@@H]4c5cc(OC)c(OC)cc5CC[N@@H+]4C)cc3)cc1)[NH+](C)CC2	ZINC000070664884	553595168	/nfs/dbraw/zinc/59/51/68/553595168.db2.gz	KSGGQJQFYBWKMO-VSJLXWSYSA-N	2	1	638.805	6.680	50	0	biogenic	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(O)c(OC)cc3c1[C@H](C2)[N@H+](C)CC3	ZINC000038148193	554270463	/nfs/dbraw/zinc/27/04/63/554270463.db2.gz	IIQSJHUEZBTSAT-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(O)c(OC)cc3c1[C@H](C2)[N@@H+](C)CC3	ZINC000038148193	554270467	/nfs/dbraw/zinc/27/04/67/554270467.db2.gz	IIQSJHUEZBTSAT-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(O)c(OC)cc3c1[C@H](C2)[NH+](C)CC3	ZINC000038148193	554270474	/nfs/dbraw/zinc/27/04/74/554270474.db2.gz	IIQSJHUEZBTSAT-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(O)c(OC)cc3c1[C@H](C2)[NH+](C)CC3	ZINC000038148193	554270471	/nfs/dbraw/zinc/27/04/71/554270471.db2.gz	IIQSJHUEZBTSAT-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
C[C@@H]1CCCC[NH+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@H](O)C[N@@H+]3CCCC[C@@H]3C)c(Br)c2)cc1Br	ZINC000150466906	571508083	/nfs/dbraw/zinc/50/80/83/571508083.db2.gz	SQBNAQMQCILGQW-CEWHCAETSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[N@H+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@H](O)C[NH+]3CCCC[C@@H]3C)c(Br)c2)cc1Br	ZINC000150466906	571508084	/nfs/dbraw/zinc/50/80/84/571508084.db2.gz	SQBNAQMQCILGQW-CEWHCAETSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[N@@H+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@H](O)C[NH+]3CCCC[C@@H]3C)c(Br)c2)cc1Br	ZINC000150466906	571508085	/nfs/dbraw/zinc/50/80/85/571508085.db2.gz	SQBNAQMQCILGQW-CEWHCAETSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[NH+]1CCCNC(=O)Nc1ccc(Cc2ccc(NC(=O)NCCC[N@@H+]3CCCC[C@H]3C)cc2)cc1	ZINC000254823487	572303678	/nfs/dbraw/zinc/30/36/78/572303678.db2.gz	KVSODEOZJBNRSP-KAYWLYCHSA-N	2	1	562.803	6.049	50	0		KKAAMP
COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@@H]5c6cc(OC)c(OC)cc6CC[NH+]5C)ccc4O)c(OC)cc3CC[N@@H+]2C)cc1	ZINC000006017976	552520206	/nfs/dbraw/zinc/52/02/06/552520206.db2.gz	MIBATSHDJRIUJK-ROJLCIKYSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@@H]5c6cc(OC)c(OC)cc6CC[N@H+]5C)ccc4O)c(OC)cc3CC[NH+]2C)cc1	ZINC000006017976	552520208	/nfs/dbraw/zinc/52/02/08/552520208.db2.gz	MIBATSHDJRIUJK-ROJLCIKYSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@@H]5c6cc(OC)c(OC)cc6CC[N@@H+]5C)ccc4O)c(OC)cc3CC[NH+]2C)cc1	ZINC000006017976	552520210	/nfs/dbraw/zinc/52/02/10/552520210.db2.gz	MIBATSHDJRIUJK-ROJLCIKYSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[N@H+](C)CC3	ZINC000079183281	553666380	/nfs/dbraw/zinc/66/63/80/553666380.db2.gz	FUZMQNZACIFDBL-IHLOFXLRSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[N@@H+](C)CC3	ZINC000079183281	553666384	/nfs/dbraw/zinc/66/63/84/553666384.db2.gz	FUZMQNZACIFDBL-IHLOFXLRSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[NH+](C)CC3	ZINC000079183281	553666387	/nfs/dbraw/zinc/66/63/87/553666387.db2.gz	FUZMQNZACIFDBL-IHLOFXLRSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[NH+](C)CC3	ZINC000079183281	553666389	/nfs/dbraw/zinc/66/63/89/553666389.db2.gz	FUZMQNZACIFDBL-IHLOFXLRSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
[NH3+][C@@H](c1ccccc1)[C@H](c1ccccc1)[PH+]1Cc2ccc3ccccc3c2-c2c(ccc3ccccc32)C1	ZINC000043763948	554299590	/nfs/dbraw/zinc/29/95/90/554299590.db2.gz	YHBAPPMVVCHAQC-ZPGRZCPFSA-N	2	1	507.617	9.597	50	0		KKAAMP
CC[N@H+]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000200528885	1071290713	/nfs/dbraw/zinc/29/07/13/1071290713.db2.gz	KKSWGFCCZGCKHG-OODHRNECSA-N	2	1	525.737	5.446	50	0		KKAAMP
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000200528885	1071290721	/nfs/dbraw/zinc/29/07/21/1071290721.db2.gz	KKSWGFCCZGCKHG-OODHRNECSA-N	2	1	525.737	5.446	50	0		KKAAMP
CC[NH+]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000200528885	1071290728	/nfs/dbraw/zinc/29/07/28/1071290728.db2.gz	KKSWGFCCZGCKHG-OODHRNECSA-N	2	1	525.737	5.446	50	0		KKAAMP
Cc1cc([C@@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716782	553995679	/nfs/dbraw/zinc/99/56/79/553995679.db2.gz	QOWNPVISDLPHGN-VSGBNLITSA-N	2	1	503.637	5.223	50	0		KKAAMP
Cc1cc([C@@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716782	553995682	/nfs/dbraw/zinc/99/56/82/553995682.db2.gz	QOWNPVISDLPHGN-VSGBNLITSA-N	2	1	503.637	5.223	50	0		KKAAMP
Cc1cc([C@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716817	553995791	/nfs/dbraw/zinc/99/57/91/553995791.db2.gz	UXUMWYGVNIKARA-NSOVKSMOSA-N	2	1	520.092	5.738	50	0		KKAAMP
Cc1cc([C@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716817	553995795	/nfs/dbraw/zinc/99/57/95/553995795.db2.gz	UXUMWYGVNIKARA-NSOVKSMOSA-N	2	1	520.092	5.738	50	0		KKAAMP
C[N@H+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000199305079	1071135724	/nfs/dbraw/zinc/13/57/24/1071135724.db2.gz	VDVXWSMCRKUYMN-YKTXNGGMSA-N	2	1	525.737	5.446	50	0		KKAAMP
C[NH+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000199305079	1071135731	/nfs/dbraw/zinc/13/57/31/1071135731.db2.gz	VDVXWSMCRKUYMN-YKTXNGGMSA-N	2	1	525.737	5.446	50	0		KKAAMP
C[NH+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000199305079	1071135737	/nfs/dbraw/zinc/13/57/37/1071135737.db2.gz	VDVXWSMCRKUYMN-YKTXNGGMSA-N	2	1	525.737	5.446	50	0		KKAAMP
CC[N@H+]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000200528915	1071290613	/nfs/dbraw/zinc/29/06/13/1071290613.db2.gz	KKSWGFCCZGCKHG-YKTXNGGMSA-N	2	1	525.737	5.446	50	0		KKAAMP
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000200528915	1071290617	/nfs/dbraw/zinc/29/06/17/1071290617.db2.gz	KKSWGFCCZGCKHG-YKTXNGGMSA-N	2	1	525.737	5.446	50	0		KKAAMP
CC[NH+]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000200528915	1071290625	/nfs/dbraw/zinc/29/06/25/1071290625.db2.gz	KKSWGFCCZGCKHG-YKTXNGGMSA-N	2	1	525.737	5.446	50	0		KKAAMP
CC(C)(C)[PH+]1Cc2ccc3ccccc3c2-c2c3ccccc3ccc2[C@H]1[C@@H]1c2ccc3ccccc3c2-c2c(ccc3ccccc32)C[P@@H+]1C(C)(C)C	ZINC000150351365	1071326543	/nfs/dbraw/zinc/32/65/43/1071326543.db2.gz	YXMFQIWDFKIXGQ-KUSQLHRJSA-N	2	1	734.904	16.004	50	0		KKAAMP
Cc1oc(-c2ccc(Cl)cc2)nc1C[N@@H+]1CCC[C@H](C(=O)NCCC[NH+](CC(C)C)CC(C)C)C1	ZINC000020240878	553626757	/nfs/dbraw/zinc/62/67/57/553626757.db2.gz	RNEXYRUGYRDLQI-DEOSSOPVSA-N	2	1	503.131	5.636	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc4c(c3Oc3cc5c(cc3OC)CC[NH+](C)[C@@H]5C2)OCO4)CC[N@H+]1C	ZINC000030726863	553855533	/nfs/dbraw/zinc/85/55/33/553855533.db2.gz	YVPXVXANRNDGTA-WDYNHAJCSA-N	2	1	606.719	6.874	50	0	aggregator,biogenic,world	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc4c(c3Oc3cc5c(cc3OC)CC[N@H+](C)[C@@H]5C2)OCO4)CC[NH+]1C	ZINC000030726863	553855528	/nfs/dbraw/zinc/85/55/28/553855528.db2.gz	YVPXVXANRNDGTA-WDYNHAJCSA-N	2	1	606.719	6.874	50	0	aggregator,biogenic,world	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc4c(c3Oc3cc5c(cc3OC)CC[NH+](C)[C@@H]5C2)OCO4)CC[N@@H+]1C	ZINC000030726863	553855536	/nfs/dbraw/zinc/85/55/36/553855536.db2.gz	YVPXVXANRNDGTA-WDYNHAJCSA-N	2	1	606.719	6.874	50	0	aggregator,biogenic,world	KKAAMP
C[NH+]1CCC(N2CCN(C(=O)[C@@H]3C[C@@H](Sc4ccc(F)cc4)C[N@H+]3Cc3ccc4c(c3)Cc3ccccc3-4)CC2)CC1	ZINC000100890045	554511577	/nfs/dbraw/zinc/51/15/77/554511577.db2.gz	IVMOSHFMAARMIX-FJQKOURKSA-N	2	1	584.805	5.371	50	0		KKAAMP
COc1ccccc1CNC(=O)CC[C@H]1C[N@H+](Cc2cccc(Cl)c2)CC[C@H]1N1CCN(c2ccccc2OC)CC1	ZINC000299761431	572135100	/nfs/dbraw/zinc/13/51/00/572135100.db2.gz	WNHJFSMZSJSLIV-MFMCTBQISA-N	2	1	591.196	5.467	50	0		KKAAMP
COc1ccccc1CNC(=O)CC[C@H]1C[N@@H+](Cc2cccc(Cl)c2)CC[C@H]1N1CCN(c2ccccc2OC)CC1	ZINC000299761431	572135103	/nfs/dbraw/zinc/13/51/03/572135103.db2.gz	WNHJFSMZSJSLIV-MFMCTBQISA-N	2	1	591.196	5.467	50	0		KKAAMP
CC(C)(C)c1cc(C[NH+]2CCC(C(=O)N3CC[NH+](Cc4ccccc4)CC3)CC2)cc(C(C)(C)C)c1O	ZINC000012630929	553405548	/nfs/dbraw/zinc/40/55/48/553405548.db2.gz	CZMQEVQPLSXXAX-UHFFFAOYSA-N	2	1	505.747	5.544	50	0		KKAAMP
C[NH+](C)CCCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000014733020	553519455	/nfs/dbraw/zinc/51/94/55/553519455.db2.gz	PFPGYUYIMNCGQA-JYFHCDHNSA-N	2	1	527.631	5.444	50	0		KKAAMP
Cc1oc(-c2ccc(Cl)cc2)nc1C[NH+]1CCC(C(=O)NCC[N@@H+](Cc2ccccc2)C(C)C)CC1	ZINC000020240752	553626698	/nfs/dbraw/zinc/62/66/98/553626698.db2.gz	UPUFCVFUIYEDMC-UHFFFAOYSA-N	2	1	509.094	5.542	50	0		KKAAMP
c1ccc([C@H]2CC[C@H](c3ccccc3)[PH+]2CC[PH+]2[C@@H](c3ccccc3)CC[C@@H]2c2ccccc2)cc1	ZINC000071769508	553636448	/nfs/dbraw/zinc/63/64/48/553636448.db2.gz	VHHAZLMVLLIMHT-YFRBGRBWSA-N	2	1	506.610	10.503	50	0		KKAAMP
COc1cc2c(cc1O)[C@@H](Cc1ccc(O)c(Oc3ccc(C[C@@H]4c5cc(OC)c(OC)cc5CC[N@@H+]4C)cc3)c1)[NH+](C)CC2	ZINC000085492224	553682504	/nfs/dbraw/zinc/68/25/04/553682504.db2.gz	BURJAQFYNVMZDV-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c(cc1O)[C@@H](Cc1ccc(O)c(Oc3ccc(C[C@@H]4c5cc(OC)c(OC)cc5CC[NH+]4C)cc3)c1)[N@H+](C)CC2	ZINC000085492224	553682506	/nfs/dbraw/zinc/68/25/06/553682506.db2.gz	BURJAQFYNVMZDV-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c(cc1O)[C@@H](Cc1ccc(O)c(Oc3ccc(C[C@@H]4c5cc(OC)c(OC)cc5CC[NH+]4C)cc3)c1)[N@@H+](C)CC2	ZINC000085492224	553682508	/nfs/dbraw/zinc/68/25/08/553682508.db2.gz	BURJAQFYNVMZDV-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	biogenic,in-vitro	KKAAMP
[NH3+][C@H](c1ccccc1)[C@@H](c1ccccc1)[PH+]1Cc2ccc3ccccc3c2-c2c(ccc3ccccc32)C1	ZINC000095611363	553705595	/nfs/dbraw/zinc/70/55/95/553705595.db2.gz	YHBAPPMVVCHAQC-LQFQNGICSA-N	2	1	507.617	9.597	50	0		KKAAMP
CC[NH+]1CCN(c2c(C[N@H+](Cc3ccccc3C(F)(F)F)CC(C)C)c(C)nn2-c2cccc(F)c2)CC1	ZINC000034835959	554020338	/nfs/dbraw/zinc/02/03/38/554020338.db2.gz	QQSKNLRYSAMJAJ-UHFFFAOYSA-N	2	1	531.642	6.139	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000058502112	554364515	/nfs/dbraw/zinc/36/45/15/554364515.db2.gz	DFOCUWZXJBAUSQ-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000058502112	554364524	/nfs/dbraw/zinc/36/45/24/554364524.db2.gz	DFOCUWZXJBAUSQ-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000058502112	554364520	/nfs/dbraw/zinc/36/45/20/554364520.db2.gz	DFOCUWZXJBAUSQ-VMPREFPWSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
CCN1CC[NH+](C2CCN(C(=O)[C@@H]3C[C@H](Sc4ccccn4)C[N@H+]3Cc3ccc4c(c3)Cc3ccccc3-4)CC2)CC1	ZINC000102650649	554995575	/nfs/dbraw/zinc/99/55/75/554995575.db2.gz	DKONEUIRAMCRIR-DITALETJSA-N	2	1	581.830	5.017	50	0		KKAAMP
CN(C(=O)CC[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1N1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CC[NH+](C)CC1	ZINC000299762083	572134777	/nfs/dbraw/zinc/13/47/77/572134777.db2.gz	KSMPYKKRQZRCEZ-JTSJOTPCSA-N	3	1	585.759	5.051	50	0		KKAAMP
CN(C(=O)CC[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1)C1CC[NH+](C)CC1	ZINC000299762083	572134781	/nfs/dbraw/zinc/13/47/81/572134781.db2.gz	KSMPYKKRQZRCEZ-JTSJOTPCSA-N	3	1	585.759	5.051	50	0		KKAAMP
c1ccc(CC[N@@H+]2[C@@H](c3ccccc3)[C@H](c3ccccc3)[C@@H]([NH2+]Cc3ccccc3)C[C@H]2c2ccccc2)cc1	ZINC000245380791	572240508	/nfs/dbraw/zinc/24/05/08/572240508.db2.gz	MTFXVXUBNOYWNP-DYLMPHRMSA-N	2	1	522.736	8.360	50	0		KKAAMP
C[C@@H]1CCCC[NH+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@@H](O)C[N@@H+]3CCCC[C@@H]3C)c(Br)c2)cc1Br	ZINC000252197602	572259902	/nfs/dbraw/zinc/25/99/02/572259902.db2.gz	SQBNAQMQCILGQW-DDOAZUFRSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[N@H+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@@H](O)C[NH+]3CCCC[C@@H]3C)c(Br)c2)cc1Br	ZINC000252197602	572259903	/nfs/dbraw/zinc/25/99/03/572259903.db2.gz	SQBNAQMQCILGQW-DDOAZUFRSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[N@@H+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@@H](O)C[NH+]3CCCC[C@@H]3C)c(Br)c2)cc1Br	ZINC000252197602	572259904	/nfs/dbraw/zinc/25/99/04/572259904.db2.gz	SQBNAQMQCILGQW-DDOAZUFRSA-N	2	1	854.357	8.291	50	0		KKAAMP
CC(=O)c1c(C)n(-c2ccc(C)cc2)c2ccc(OC[C@H](O)C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cc21	ZINC000009409354	553257180	/nfs/dbraw/zinc/25/71/80/553257180.db2.gz	WZYOLYLGHVLBLE-GDLZYMKVSA-N	2	1	525.693	5.444	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@@H+](C)[C@@H]4C2)CC[NH+]1C	ZINC000085977445	553692518	/nfs/dbraw/zinc/69/25/18/553692518.db2.gz	QAFGBLDGRLFICB-FQLXRVMXSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@H+](C)[C@@H]4C2)CC[NH+]1C	ZINC000085977445	553692520	/nfs/dbraw/zinc/69/25/20/553692520.db2.gz	QAFGBLDGRLFICB-FQLXRVMXSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@@H]4C2)CC[N@H+]1C	ZINC000085977445	553692523	/nfs/dbraw/zinc/69/25/23/553692523.db2.gz	QAFGBLDGRLFICB-FQLXRVMXSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@@H]4C2)CC[N@@H+]1C	ZINC000085977445	553692525	/nfs/dbraw/zinc/69/25/25/553692525.db2.gz	QAFGBLDGRLFICB-FQLXRVMXSA-N	2	1	638.761	6.868	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000030726949	553855626	/nfs/dbraw/zinc/85/56/26/553855626.db2.gz	DFOCUWZXJBAUSQ-FQLXRVMXSA-N	2	1	608.735	6.859	50	0	in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000030726949	553855623	/nfs/dbraw/zinc/85/56/23/553855623.db2.gz	DFOCUWZXJBAUSQ-FQLXRVMXSA-N	2	1	608.735	6.859	50	0	in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000030726949	553855629	/nfs/dbraw/zinc/85/56/29/553855629.db2.gz	DFOCUWZXJBAUSQ-FQLXRVMXSA-N	2	1	608.735	6.859	50	0	in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1[NH2+]CCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[N@@H+](C)CC3	ZINC000033357222	553947409	/nfs/dbraw/zinc/94/74/09/553947409.db2.gz	JFOOZQIJNIJCOW-VMPREFPWSA-N	2	1	638.761	6.829	50	0	biogenic	KKAAMP
Cc1cc([C@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716781	553995637	/nfs/dbraw/zinc/99/56/37/553995637.db2.gz	QOWNPVISDLPHGN-NSOVKSMOSA-N	2	1	503.637	5.223	50	0		KKAAMP
Cc1cc([C@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716781	553995638	/nfs/dbraw/zinc/99/56/38/553995638.db2.gz	QOWNPVISDLPHGN-NSOVKSMOSA-N	2	1	503.637	5.223	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@@H+](C)[C@H]4C2)CC[NH+]1C	ZINC000044281335	554301514	/nfs/dbraw/zinc/30/15/14/554301514.db2.gz	QAFGBLDGRLFICB-VMPREFPWSA-N	2	1	638.761	6.868	50	0	biogenic	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@H+](C)[C@H]4C2)CC[NH+]1C	ZINC000044281335	554301518	/nfs/dbraw/zinc/30/15/18/554301518.db2.gz	QAFGBLDGRLFICB-VMPREFPWSA-N	2	1	638.761	6.868	50	0	biogenic	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@H]4C2)CC[N@H+]1C	ZINC000044281335	554301522	/nfs/dbraw/zinc/30/15/22/554301522.db2.gz	QAFGBLDGRLFICB-VMPREFPWSA-N	2	1	638.761	6.868	50	0	biogenic	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@H]4C2)CC[N@@H+]1C	ZINC000044281335	554301525	/nfs/dbraw/zinc/30/15/25/554301525.db2.gz	QAFGBLDGRLFICB-VMPREFPWSA-N	2	1	638.761	6.868	50	0	biogenic	KKAAMP
COc1cc2c(cc1OC)[C@H](Cc1ccc(OCOc3ccc(C[C@H]4c5cc(OC)c(OC)cc5CC[N@@H+]4C)cc3)cc1)[NH+](C)CC2	ZINC000106588079	571413029	/nfs/dbraw/zinc/41/30/29/571413029.db2.gz	KSGGQJQFYBWKMO-PXLJZGITSA-N	2	1	638.805	6.680	50	0	biogenic	KKAAMP
C[C@@H]1CCCC[NH+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@H](O)C[N@@H+]3CCCC[C@H]3C)c(Br)c2)cc1Br	ZINC000252197604	572259888	/nfs/dbraw/zinc/25/98/88/572259888.db2.gz	SQBNAQMQCILGQW-QMWXCIFZSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[NH+]1C[C@@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@@H](O)C[N@@H+]3CCCC[C@H]3C)c(Br)c2)cc1Br	ZINC000252197604	572259889	/nfs/dbraw/zinc/25/98/89/572259889.db2.gz	SQBNAQMQCILGQW-QMWXCIFZSA-N	2	1	854.357	8.291	50	0		KKAAMP
C[C@@H]1CCCC[NH+]1C[C@@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@@H](O)C[N@H+]3CCCC[C@H]3C)c(Br)c2)cc1Br	ZINC000252197604	572259890	/nfs/dbraw/zinc/25/98/90/572259890.db2.gz	SQBNAQMQCILGQW-QMWXCIFZSA-N	2	1	854.357	8.291	50	0		KKAAMP
CC(C)(C)OC[C@H](O)C[NH+]1CCC(N2CCC(N(C(=O)C3CCCCC3)c3ccc(C(F)(F)F)cn3)CC2)CC1	ZINC000252501887	572261828	/nfs/dbraw/zinc/26/18/28/572261828.db2.gz	UKLJBKKXUYJXOV-AREMUKBSSA-N	2	1	568.725	5.119	50	0		KKAAMP
O=C(NCCC[NH+]1CCOCC1)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000200576394	1071290427	/nfs/dbraw/zinc/29/04/27/1071290427.db2.gz	FGCPFWYNKOGINB-LBNVMWSVSA-N	2	1	569.668	5.214	50	0		KKAAMP
O=C(NCCC[NH+]1CCOCC1)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000200576394	1071290436	/nfs/dbraw/zinc/29/04/36/1071290436.db2.gz	FGCPFWYNKOGINB-LBNVMWSVSA-N	2	1	569.668	5.214	50	0		KKAAMP
COc1ccc(NC(=O)CC[C@H]2C[N@@H+](CC(c3ccccc3)c3ccccc3)CC[C@H]2[NH+](C)C)cc1OC	ZINC000011998059	553349965	/nfs/dbraw/zinc/34/99/65/553349965.db2.gz	AHNXHGUWRXDMKP-LITSAYRRSA-N	2	1	515.698	5.507	50	0		KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000070454179	553593988	/nfs/dbraw/zinc/59/39/88/553593988.db2.gz	HGNHIFJNOKGSKI-URLMMPGGSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000070454179	553593991	/nfs/dbraw/zinc/59/39/91/553593991.db2.gz	HGNHIFJNOKGSKI-URLMMPGGSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000070454179	553593995	/nfs/dbraw/zinc/59/39/95/553593995.db2.gz	HGNHIFJNOKGSKI-URLMMPGGSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[N@H+](C)CC3	ZINC000019685806	553615376	/nfs/dbraw/zinc/61/53/76/553615376.db2.gz	FUZMQNZACIFDBL-KYJUHHDHSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[N@@H+](C)CC3	ZINC000019685806	553615378	/nfs/dbraw/zinc/61/53/78/553615378.db2.gz	FUZMQNZACIFDBL-KYJUHHDHSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[NH+](C)CC3	ZINC000019685806	553615380	/nfs/dbraw/zinc/61/53/80/553615380.db2.gz	FUZMQNZACIFDBL-KYJUHHDHSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)[NH+](C)CC3	ZINC000019685806	553615383	/nfs/dbraw/zinc/61/53/83/553615383.db2.gz	FUZMQNZACIFDBL-KYJUHHDHSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
Cc1cc([C@@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716818	553995733	/nfs/dbraw/zinc/99/57/33/553995733.db2.gz	UXUMWYGVNIKARA-VSGBNLITSA-N	2	1	520.092	5.738	50	0		KKAAMP
Cc1cc([C@@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716818	553995736	/nfs/dbraw/zinc/99/57/36/553995736.db2.gz	UXUMWYGVNIKARA-VSGBNLITSA-N	2	1	520.092	5.738	50	0		KKAAMP
C[N@@H+](Cc1cccs1)Cc1cccc(OCCN2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000012054965	1071216336	/nfs/dbraw/zinc/21/63/36/1071216336.db2.gz	KNEZMXLRIJRJDB-UHFFFAOYSA-N	2	1	517.617	5.236	50	0		KKAAMP
C[C@H]1CCCC[NH+]1CCCNC(=O)Nc1ccc(Cc2ccc(NC(=O)NCCC[N@@H+]3CCCC[C@@H]3C)cc2)cc1	ZINC000005648404	552505971	/nfs/dbraw/zinc/50/59/71/552505971.db2.gz	KVSODEOZJBNRSP-SVBPBHIXSA-N	2	1	562.803	6.049	50	0		KKAAMP
CC(C)[NH+](CCNC(=O)CCCCCCCCC(=O)NCC[N@@H+](Cc1ccccc1)C(C)C)Cc1ccccc1	ZINC000009312349	553240280	/nfs/dbraw/zinc/24/02/80/553240280.db2.gz	OEYFJYJBFQPVCC-UHFFFAOYSA-N	2	1	550.832	6.161	50	0		KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)c(Oc3cc4c(cc3OC)CC[N@@H+](C)[C@@H]4Cc3ccc(O)cc3)c1)[NH+](C)CC2	ZINC000070455321	553593814	/nfs/dbraw/zinc/59/38/14/553593814.db2.gz	XCUCMLUTCAKSOZ-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	endogenous,in-man	KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)c(Oc3cc4c(cc3OC)CC[NH+](C)[C@@H]4Cc3ccc(O)cc3)c1)[N@H+](C)CC2	ZINC000070455321	553593816	/nfs/dbraw/zinc/59/38/16/553593816.db2.gz	XCUCMLUTCAKSOZ-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	endogenous,in-man	KKAAMP
COc1cc2c(cc1OC)[C@@H](Cc1ccc(O)c(Oc3cc4c(cc3OC)CC[NH+](C)[C@@H]4Cc3ccc(O)cc3)c1)[N@@H+](C)CC2	ZINC000070455321	553593821	/nfs/dbraw/zinc/59/38/21/553593821.db2.gz	XCUCMLUTCAKSOZ-FIRIVFDPSA-N	2	1	610.751	6.459	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000030726840	553855699	/nfs/dbraw/zinc/85/56/99/553855699.db2.gz	DFOCUWZXJBAUSQ-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000030726840	553855695	/nfs/dbraw/zinc/85/56/95/553855695.db2.gz	DFOCUWZXJBAUSQ-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000030726840	553855702	/nfs/dbraw/zinc/85/57/02/553855702.db2.gz	DFOCUWZXJBAUSQ-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
O=C(c1ccc(C[NH+]2CCc3ccccc3C2)cc1)N1CCN(C(=O)c2ccc(C[N@H+]3CCc4ccccc4C3)cc2)CC1	ZINC000100181545	554241952	/nfs/dbraw/zinc/24/19/52/554241952.db2.gz	BOWAMZRCBVQGNT-UHFFFAOYSA-N	2	1	584.764	5.401	50	0		KKAAMP
CC(C)(C)[PH+]1Cc2ccc3ccccc3c2-c2c3ccccc3ccc2[C@@H]1[C@H]1c2ccc3ccccc3c2-c2c(ccc3ccccc32)C[P@@H+]1C(C)(C)C	ZINC000150352001	571462330	/nfs/dbraw/zinc/46/23/30/571462330.db2.gz	YXMFQIWDFKIXGQ-JBOWJRQASA-N	2	1	734.904	16.004	50	0		KKAAMP
CC(=O)c1c(C)n(-c2ccc(C)cc2)c2ccc(OC[C@@H](O)C[NH2+]C3CC[NH+](Cc4ccccc4)CC3)cc21	ZINC000009409355	553257189	/nfs/dbraw/zinc/25/71/89/553257189.db2.gz	WZYOLYLGHVLBLE-LJAQVGFWSA-N	2	1	525.693	5.444	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(cc3CC[N@H+]1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)[NH+](C)CC3	ZINC000030726936	553855596	/nfs/dbraw/zinc/85/55/96/553855596.db2.gz	UUURWWVPMHAACP-KYJUHHDHSA-N	2	1	622.762	7.162	50	0	in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(cc3CC[NH+]1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)[N@@H+](C)CC3	ZINC000030726936	553855592	/nfs/dbraw/zinc/85/55/92/553855592.db2.gz	UUURWWVPMHAACP-KYJUHHDHSA-N	2	1	622.762	7.162	50	0	in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(cc3CC[N@@H+]1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)[NH+](C)CC3	ZINC000030726936	553855601	/nfs/dbraw/zinc/85/56/01/553855601.db2.gz	UUURWWVPMHAACP-KYJUHHDHSA-N	2	1	622.762	7.162	50	0	in-vitro	KKAAMP
Cc1cc([C@@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716816	553995574	/nfs/dbraw/zinc/99/55/74/553995574.db2.gz	UXUMWYGVNIKARA-IZLXSDGUSA-N	2	1	520.092	5.738	50	0		KKAAMP
Cc1cc([C@@H]2C[C@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccccc3Cl)C2)ccc1F	ZINC000034716816	553995577	/nfs/dbraw/zinc/99/55/77/553995577.db2.gz	UXUMWYGVNIKARA-IZLXSDGUSA-N	2	1	520.092	5.738	50	0		KKAAMP
C[C@H](CNC(=O)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1)NC(=O)c1ccc(C[NH+]2CCc3ccccc3C2)cc1	ZINC000102034445	554868753	/nfs/dbraw/zinc/86/87/53/554868753.db2.gz	VWYBOQZLIDFHCH-HHHXNRCGSA-N	2	1	572.753	5.352	50	0		KKAAMP
C[C@H](CNC(=O)c1ccc(C[NH+]2CCc3ccccc3C2)cc1)NC(=O)c1ccc(C[N@@H+]2CCc3ccccc3C2)cc1	ZINC000102034445	554868755	/nfs/dbraw/zinc/86/87/55/554868755.db2.gz	VWYBOQZLIDFHCH-HHHXNRCGSA-N	2	1	572.753	5.352	50	0		KKAAMP
C[C@H](CNC(=O)c1ccc(C[NH+]2CCc3ccccc3C2)cc1)NC(=O)c1ccc(C[N@H+]2CCc3ccccc3C2)cc1	ZINC000102034445	554868758	/nfs/dbraw/zinc/86/87/58/554868758.db2.gz	VWYBOQZLIDFHCH-HHHXNRCGSA-N	2	1	572.753	5.352	50	0		KKAAMP
C[N@@H+]1CCCN(C(=O)[C@@H]2C[C@@H](Sc3nc4ccccc4[nH]3)C[NH+]2Cc2ccc(OCc3ccccc3)cc2)CC1	ZINC000102104862	554882370	/nfs/dbraw/zinc/88/23/70/554882370.db2.gz	JZKPYWHSPIQFTQ-OFSOJUDTSA-N	2	1	555.748	5.041	50	0		KKAAMP
C[N@H+]1CCCN(C(=O)[C@@H]2C[C@@H](Sc3nc4ccccc4[nH]3)C[NH+]2Cc2ccc(OCc3ccccc3)cc2)CC1	ZINC000102104862	554882372	/nfs/dbraw/zinc/88/23/72/554882372.db2.gz	JZKPYWHSPIQFTQ-OFSOJUDTSA-N	2	1	555.748	5.041	50	0		KKAAMP
C[NH+]1CCCN(C(=O)[C@@H]2C[C@@H](Sc3nc4ccccc4[nH]3)C[N@@H+]2Cc2ccc(OCc3ccccc3)cc2)CC1	ZINC000102104862	554882376	/nfs/dbraw/zinc/88/23/76/554882376.db2.gz	JZKPYWHSPIQFTQ-OFSOJUDTSA-N	2	1	555.748	5.041	50	0		KKAAMP
C[NH+]1CCCN(C(=O)[C@@H]2C[C@@H](Sc3nc4ccccc4[nH]3)C[N@H+]2Cc2ccc(OCc3ccccc3)cc2)CC1	ZINC000102104862	554882378	/nfs/dbraw/zinc/88/23/78/554882378.db2.gz	JZKPYWHSPIQFTQ-OFSOJUDTSA-N	2	1	555.748	5.041	50	0		KKAAMP
C[N@H+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000102432687	554927266	/nfs/dbraw/zinc/92/72/66/554927266.db2.gz	WRQBVIWRODFOBK-HWUUJZMBSA-N	2	1	553.669	5.976	50	0		KKAAMP
C[NH+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000102432687	554927268	/nfs/dbraw/zinc/92/72/68/554927268.db2.gz	WRQBVIWRODFOBK-HWUUJZMBSA-N	2	1	553.669	5.976	50	0		KKAAMP
C[NH+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(C(F)(F)F)c2)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000102432687	554927271	/nfs/dbraw/zinc/92/72/71/554927271.db2.gz	WRQBVIWRODFOBK-HWUUJZMBSA-N	2	1	553.669	5.976	50	0		KKAAMP
COc1ccc(C[C@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)cc6CC[NH+]5C)ccc4O)c(OC)cc3CC[N@@H+]2C)cc1	ZINC000070454233	562716323	/nfs/dbraw/zinc/71/63/23/562716323.db2.gz	MIBATSHDJRIUJK-ACHIHNKUSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc(C[C@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)cc6CC[N@H+]5C)ccc4O)c(OC)cc3CC[NH+]2C)cc1	ZINC000070454233	562716324	/nfs/dbraw/zinc/71/63/24/562716324.db2.gz	MIBATSHDJRIUJK-ACHIHNKUSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc(C[C@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)cc6CC[N@@H+]5C)ccc4O)c(OC)cc3CC[NH+]2C)cc1	ZINC000070454233	562716325	/nfs/dbraw/zinc/71/63/25/562716325.db2.gz	MIBATSHDJRIUJK-ACHIHNKUSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
C[C@@H]1CCCC[NH+]1C[C@H](O)COc1c(Br)cc(C(C)(C)c2cc(Br)c(OC[C@@H](O)C[N@@H+]3CCCC[C@H]3C)c(Br)c2)cc1Br	ZINC000252197603	572259921	/nfs/dbraw/zinc/25/99/21/572259921.db2.gz	SQBNAQMQCILGQW-PWGHIRGTSA-N	2	1	854.357	8.291	50	0		KKAAMP
O=C(C1CCCCC1)N(c1ccc(C(F)(F)F)cn1)C1CCN(C2CC[NH+](CCOc3ccccc3)CC2)CC1	ZINC000252503565	572261914	/nfs/dbraw/zinc/26/19/14/572261914.db2.gz	VFHPFHYQFNGXBR-UHFFFAOYSA-N	2	1	558.689	6.022	50	0		KKAAMP
COc1ccccc1N1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2CCC(=O)N2CCCCCCC2)CC1	ZINC000102128637	1069843687	/nfs/dbraw/zinc/84/36/87/1069843687.db2.gz	JRIBTVDKDBJPQE-XZWHSSHBSA-N	2	1	532.773	5.281	50	0		KKAAMP
C[N@H+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000014745148	1072892336	/nfs/dbraw/zinc/89/23/36/1072892336.db2.gz	MYWFHUYVRQMXAM-HWUUJZMBSA-N	2	1	503.662	5.097	50	0		KKAAMP
C[NH+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000014745148	1072892356	/nfs/dbraw/zinc/89/23/56/1072892356.db2.gz	MYWFHUYVRQMXAM-HWUUJZMBSA-N	2	1	503.662	5.097	50	0		KKAAMP
C[NH+]1CCC[C@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000014745148	1072892370	/nfs/dbraw/zinc/89/23/70/1072892370.db2.gz	MYWFHUYVRQMXAM-HWUUJZMBSA-N	2	1	503.662	5.097	50	0		KKAAMP
C[C@@H]1CC[C@@H](c2ccoc2)[NH+]2[C@H](O)[C@@]3(C[C@@]4(CS3)CC[C@H]3[C@H](C)CC[C@@H](c5ccoc5)[N@@H+]3[C@H]4O)CC[C@@H]12	ZINC001501058422	1072922372	/nfs/dbraw/zinc/92/23/72/1072922372.db2.gz	DYEOLAMWQVWASS-QMARKCQSSA-N	2	1	526.743	5.943	50	0		KKAAMP
C[C@@H]1CC[C@@H](c2ccoc2)[NH+]2[C@@H](O)[C@]3(CS[C@]4(C3)CC[C@H]3[C@H](C)CC[C@@H](c5ccoc5)[N@@H+]3[C@@H]4O)CC[C@@H]12	ZINC001501058422	1072922380	/nfs/dbraw/zinc/92/23/80/1072922380.db2.gz	DYEOLAMWQVWASS-QMARKCQSSA-N	2	1	526.743	5.943	50	0		KKAAMP
COc1cc2c3c(c1O)Oc1ccc(cc1)C[C@@H]1c4cc(c(OC)cc4CC[N@H+]1C)Oc1cc(ccc1O)C[C@H]3[NH+](C)CC2	ZINC000004098030	552436435	/nfs/dbraw/zinc/43/64/35/552436435.db2.gz	NGZXDRGWBULKFA-VSGBNLITSA-N	2	1	594.708	6.556	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3c(c1O)Oc1ccc(cc1)C[C@@H]1c4cc(c(OC)cc4CC[NH+]1C)Oc1cc(ccc1O)C[C@H]3[N@H+](C)CC2	ZINC000004098030	552436437	/nfs/dbraw/zinc/43/64/37/552436437.db2.gz	NGZXDRGWBULKFA-VSGBNLITSA-N	2	1	594.708	6.556	50	0	biogenic,in-vitro	KKAAMP
COc1cc2c3c(c1O)Oc1ccc(cc1)C[C@@H]1c4cc(c(OC)cc4CC[NH+]1C)Oc1cc(ccc1O)C[C@H]3[N@@H+](C)CC2	ZINC000004098030	552436440	/nfs/dbraw/zinc/43/64/40/552436440.db2.gz	NGZXDRGWBULKFA-VSGBNLITSA-N	2	1	594.708	6.556	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(cc3CC[NH+]1C)Oc1c(OC)c(OC)cc3c1[C@@H](C2)[N@@H+](C)CC3	ZINC000070664863	553595204	/nfs/dbraw/zinc/59/52/04/553595204.db2.gz	UUURWWVPMHAACP-XZWHSSHBSA-N	2	1	622.762	7.162	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(cc3CC[N@H+]1C)Oc1c(OC)c(OC)cc3c1[C@@H](C2)[NH+](C)CC3	ZINC000070664863	553595208	/nfs/dbraw/zinc/59/52/08/553595208.db2.gz	UUURWWVPMHAACP-XZWHSSHBSA-N	2	1	622.762	7.162	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(cc3CC[N@@H+]1C)Oc1c(OC)c(OC)cc3c1[C@@H](C2)[NH+](C)CC3	ZINC000070664863	553595212	/nfs/dbraw/zinc/59/52/12/553595212.db2.gz	UUURWWVPMHAACP-XZWHSSHBSA-N	2	1	622.762	7.162	50	0	biogenic,in-vitro	KKAAMP
Cc1cc([C@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716783	553995774	/nfs/dbraw/zinc/99/57/74/553995774.db2.gz	QOWNPVISDLPHGN-WUFINQPMSA-N	2	1	503.637	5.223	50	0		KKAAMP
Cc1cc([C@H]2C[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C[N@@H+](Cc3ccc(F)cc3)C2)ccc1F	ZINC000034716783	553995778	/nfs/dbraw/zinc/99/57/78/553995778.db2.gz	QOWNPVISDLPHGN-WUFINQPMSA-N	2	1	503.637	5.223	50	0		KKAAMP
CCCc1nn(-c2cccc(Cl)c2)c(N2CC[NH+](C)CC2)c1C[N@@H+](Cc1sccc1C)C(C)C	ZINC000034837038	554020390	/nfs/dbraw/zinc/02/03/90/554020390.db2.gz	MTMPWWRKGLUPGM-UHFFFAOYSA-N	2	1	500.156	6.011	50	0		KKAAMP
CCCc1nn(-c2cccc(Cl)c2)c(N2CC[NH+](C)CC2)c1C[N@H+](Cc1sccc1C)C(C)C	ZINC000034837038	554020387	/nfs/dbraw/zinc/02/03/87/554020387.db2.gz	MTMPWWRKGLUPGM-UHFFFAOYSA-N	2	1	500.156	6.011	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)[N@@H+](C)CC3	ZINC000040163549	554282755	/nfs/dbraw/zinc/28/27/55/554282755.db2.gz	IIQSJHUEZBTSAT-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)[N@H+](C)CC3	ZINC000040163549	554282754	/nfs/dbraw/zinc/28/27/54/554282754.db2.gz	IIQSJHUEZBTSAT-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)[NH+](C)CC3	ZINC000040163549	554282758	/nfs/dbraw/zinc/28/27/58/554282758.db2.gz	IIQSJHUEZBTSAT-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[N@H+](C)CC3	ZINC000040163547	554282772	/nfs/dbraw/zinc/28/27/72/554282772.db2.gz	FUZMQNZACIFDBL-LOYHVIPDSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[NH+](C)CC3	ZINC000040163547	554282779	/nfs/dbraw/zinc/28/27/79/554282779.db2.gz	FUZMQNZACIFDBL-LOYHVIPDSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(O)c(OC)cc3c1[C@@H](C2)[NH+](C)CC3	ZINC000040163549	554282761	/nfs/dbraw/zinc/28/27/61/554282761.db2.gz	IIQSJHUEZBTSAT-URLMMPGGSA-N	2	1	608.735	6.859	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[N@@H+](C)CC3	ZINC000040163547	554282775	/nfs/dbraw/zinc/28/27/75/554282775.db2.gz	FUZMQNZACIFDBL-LOYHVIPDSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)[NH+](C)CC3	ZINC000040163547	554282781	/nfs/dbraw/zinc/28/27/81/554282781.db2.gz	FUZMQNZACIFDBL-LOYHVIPDSA-N	2	1	652.788	7.171	50	0	biogenic,in-vitro	KKAAMP
COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)cc6CC[NH+]5C)ccc4O)c(OC)cc3CC[N@@H+]2C)cc1	ZINC000100822831	554481442	/nfs/dbraw/zinc/48/14/42/554481442.db2.gz	MIBATSHDJRIUJK-ZWXJPIIXSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)cc6CC[N@H+]5C)ccc4O)c(OC)cc3CC[NH+]2C)cc1	ZINC000100822831	554481446	/nfs/dbraw/zinc/48/14/46/554481446.db2.gz	MIBATSHDJRIUJK-ZWXJPIIXSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
COc1ccc(C[C@@H]2c3cc(Oc4cc(C[C@H]5c6cc(OC)c(OC)cc6CC[N@@H+]5C)ccc4O)c(OC)cc3CC[NH+]2C)cc1	ZINC000100822831	554481448	/nfs/dbraw/zinc/48/14/48/554481448.db2.gz	MIBATSHDJRIUJK-ZWXJPIIXSA-N	2	1	624.778	6.762	50	0	endogenous,in-man	KKAAMP
Cc1ccnc(S[C@H]2C[C@@H](C(=O)N3CC[NH+](C4C5CC6CC(C5)CC4C6)CC3)[N@H+](Cc3ccc(C(C)C)cc3)C2)n1	ZINC000102004642	554866716	/nfs/dbraw/zinc/86/67/16/554866716.db2.gz	LNPMLLZPENJYGV-AHYUZBCLSA-N	2	1	573.851	5.613	50	0		KKAAMP
Cc1ccnc(S[C@H]2C[C@@H](C(=O)N3CC[NH+](C4C5CC6CC(C5)CC4C6)CC3)[N@@H+](Cc3ccc(C(C)C)cc3)C2)n1	ZINC000102004642	554866718	/nfs/dbraw/zinc/86/67/18/554866718.db2.gz	LNPMLLZPENJYGV-AHYUZBCLSA-N	2	1	573.851	5.613	50	0		KKAAMP
CC(=O)c1ccc(N2CCN(C(=O)CC[C@H]3C[N@H+](CC(c4ccccc4)c4ccccc4)CC[C@H]3[NH+](C)C)CC2)cc1	ZINC000102628074	554988494	/nfs/dbraw/zinc/98/84/94/554988494.db2.gz	LGEVMOWBQZTFIL-HJIQQCSTSA-N	2	1	566.790	5.402	50	0		KKAAMP
COc1ccc(C([NH2+]CCOC(=O)NCCCCCCOP(OCCC#N)[NH+](C(C)C)C(C)C)(c2ccccc2)c2ccccc2)cc1	ZINC000150353347	571462715	/nfs/dbraw/zinc/46/27/15/571462715.db2.gz	VTFLXOVDKJUHER-UHFFFAOYSA-N	2	1	676.839	8.156	50	0		KKAAMP
COc1cc(/C=C\C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)c1OC	ZINC000150604768	1071174856	/nfs/dbraw/zinc/17/48/56/1071174856.db2.gz	QYZYVFHHHAUMJI-VHXPQNKSSA-N	2	1	688.935	7.686	50	0		KKAAMP
COc1cc(/C=C\C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)c1OC	ZINC000150604768	1071174880	/nfs/dbraw/zinc/17/48/80/1071174880.db2.gz	QYZYVFHHHAUMJI-VHXPQNKSSA-N	2	1	688.935	7.686	50	0		KKAAMP
COc1cc(/C=C\C(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)c1OC	ZINC000150604768	1071174863	/nfs/dbraw/zinc/17/48/63/1071174863.db2.gz	QYZYVFHHHAUMJI-VHXPQNKSSA-N	2	1	688.935	7.686	50	0		KKAAMP
COc1cc(/C=C\C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)c1OC	ZINC000150604768	1071174872	/nfs/dbraw/zinc/17/48/72/1071174872.db2.gz	QYZYVFHHHAUMJI-VHXPQNKSSA-N	2	1	688.935	7.686	50	0		KKAAMP
C[N@H+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000014745147	1072892201	/nfs/dbraw/zinc/89/22/01/1072892201.db2.gz	MYWFHUYVRQMXAM-WIDNXDAUSA-N	2	1	503.662	5.097	50	0		KKAAMP
C[NH+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000014745147	1072892219	/nfs/dbraw/zinc/89/22/19/1072892219.db2.gz	MYWFHUYVRQMXAM-WIDNXDAUSA-N	2	1	503.662	5.097	50	0		KKAAMP
C[NH+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2cccc(F)c2)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000014745147	1072892232	/nfs/dbraw/zinc/89/22/32/1072892232.db2.gz	MYWFHUYVRQMXAM-WIDNXDAUSA-N	2	1	503.662	5.097	50	0		KKAAMP
Cc1oc(-c2ccc(Cl)cc2)nc1C[N@@H+]1CCC[C@@H](C(=O)NCCC[NH+](CC(C)C)CC(C)C)C1	ZINC000020240876	553626806	/nfs/dbraw/zinc/62/68/06/553626806.db2.gz	RNEXYRUGYRDLQI-XMMPIXPASA-N	2	1	503.131	5.636	50	0		KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@@H+](C)[C@@H]4C2)CC[NH+]1C	ZINC000085541019	553683104	/nfs/dbraw/zinc/68/31/04/553683104.db2.gz	QAFGBLDGRLFICB-WDYNHAJCSA-N	2	1	638.761	6.868	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[N@H+](C)[C@@H]4C2)CC[NH+]1C	ZINC000085541019	553683106	/nfs/dbraw/zinc/68/31/06/553683106.db2.gz	QAFGBLDGRLFICB-WDYNHAJCSA-N	2	1	638.761	6.868	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@@H]4C2)CC[N@H+]1C	ZINC000085541019	553683108	/nfs/dbraw/zinc/68/31/08/553683108.db2.gz	QAFGBLDGRLFICB-WDYNHAJCSA-N	2	1	638.761	6.868	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(c(O)c(OC)c(OC)c3Oc3cc4c(cc3OC)CC[NH+](C)[C@@H]4C2)CC[N@@H+]1C	ZINC000085541019	553683110	/nfs/dbraw/zinc/68/31/10/553683110.db2.gz	QAFGBLDGRLFICB-WDYNHAJCSA-N	2	1	638.761	6.868	50	0	biogenic,in-vitro	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@@H+]1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)[NH+](C)CC3	ZINC000028116057	553837833	/nfs/dbraw/zinc/83/78/33/553837833.db2.gz	WVTKBKWTSCPRNU-KYJUHHDHSA-N	2	1	622.762	7.162	50	0	endogenous,in-man	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[NH+]1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)[N@@H+](C)CC3	ZINC000028116057	553837829	/nfs/dbraw/zinc/83/78/29/553837829.db2.gz	WVTKBKWTSCPRNU-KYJUHHDHSA-N	2	1	622.762	7.162	50	0	endogenous,in-man	KKAAMP
COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CC[N@H+]1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)[NH+](C)CC3	ZINC000028116057	553837837	/nfs/dbraw/zinc/83/78/37/553837837.db2.gz	WVTKBKWTSCPRNU-KYJUHHDHSA-N	2	1	622.762	7.162	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]3[N@@H+](C)CC2)[NH+](C)CC4	ZINC000030726947	553855427	/nfs/dbraw/zinc/85/54/27/553855427.db2.gz	HGNHIFJNOKGSKI-WDYNHAJCSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]3[NH+](C)CC2)[N@@H+](C)CC4	ZINC000030726947	553855436	/nfs/dbraw/zinc/85/54/36/553855436.db2.gz	HGNHIFJNOKGSKI-WDYNHAJCSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@H](Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]3[NH+](C)CC2)[N@H+](C)CC4	ZINC000030726947	553855432	/nfs/dbraw/zinc/85/54/32/553855432.db2.gz	HGNHIFJNOKGSKI-WDYNHAJCSA-N	2	1	608.735	6.859	50	0	endogenous,in-man	KKAAMP
COc1cc(/C=C/C(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)c1OC	ZINC000097981057	553991909	/nfs/dbraw/zinc/99/19/09/553991909.db2.gz	QYZYVFHHHAUMJI-WCWDXBQESA-N	2	1	688.935	7.686	50	0		KKAAMP
COc1cc(/C=C/C(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)c1OC	ZINC000097981057	553991917	/nfs/dbraw/zinc/99/19/17/553991917.db2.gz	QYZYVFHHHAUMJI-WCWDXBQESA-N	2	1	688.935	7.686	50	0		KKAAMP
COc1cc(/C=C/C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[N@H+](C)C2CCCCC2)c1OC	ZINC000097981057	553991921	/nfs/dbraw/zinc/99/19/21/553991921.db2.gz	QYZYVFHHHAUMJI-WCWDXBQESA-N	2	1	688.935	7.686	50	0		KKAAMP
COc1cc(/C=C/C(=O)Nc2ccccc2C[NH+](C)C2CCCCC2)cc(S(=O)(=O)Nc2ccccc2C[N@@H+](C)C2CCCCC2)c1OC	ZINC000097981057	553991926	/nfs/dbraw/zinc/99/19/26/553991926.db2.gz	QYZYVFHHHAUMJI-WCWDXBQESA-N	2	1	688.935	7.686	50	0		KKAAMP
c1ccc([C@@H]2CC[C@@H](c3ccccc3)[PH+]2CC[PH+]2[C@H](c3ccccc3)CC[C@H]2c2ccccc2)cc1	ZINC000060290818	554504931	/nfs/dbraw/zinc/50/49/31/554504931.db2.gz	VHHAZLMVLLIMHT-CUPIEXAXSA-N	2	1	506.610	10.503	50	0		KKAAMP
c1ccc(CC[N@H+]2[C@H](c3ccccc3)C[C@H]([NH2+]Cc3ccccc3)[C@@H](c3ccccc3)[C@H]2c2ccccc2)cc1	ZINC000106586649	571413075	/nfs/dbraw/zinc/41/30/75/571413075.db2.gz	MTFXVXUBNOYWNP-CDBYGCFJSA-N	2	1	522.736	8.360	50	0		KKAAMP
c1ccc(CC[N@H+]2[C@H](c3ccccc3)C[C@H]([NH2+]Cc3ccccc3)[C@H](c3ccccc3)[C@H]2c2ccccc2)cc1	ZINC000245380792	572240498	/nfs/dbraw/zinc/24/04/98/572240498.db2.gz	MTFXVXUBNOYWNP-IZBQCXFTSA-N	2	1	522.736	8.360	50	0		KKAAMP
C[N@H+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[NH+](Cc2ccc3ccccc3c2)C1	ZINC000199305058	1071135688	/nfs/dbraw/zinc/13/56/88/1071135688.db2.gz	VDVXWSMCRKUYMN-OODHRNECSA-N	2	1	525.737	5.446	50	0		KKAAMP
C[NH+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@H+](Cc2ccc3ccccc3c2)C1	ZINC000199305058	1071135698	/nfs/dbraw/zinc/13/56/98/1071135698.db2.gz	VDVXWSMCRKUYMN-OODHRNECSA-N	2	1	525.737	5.446	50	0		KKAAMP
C[NH+]1CCC[C@@H]1CCNC(=O)[C@@H]1C[C@H](COc2ccc3c(c2)CCC3)C[N@@H+](Cc2ccc3ccccc3c2)C1	ZINC000199305058	1071135710	/nfs/dbraw/zinc/13/57/10/1071135710.db2.gz	VDVXWSMCRKUYMN-OODHRNECSA-N	2	1	525.737	5.446	50	0		KKAAMP
C[C@@H]1CC[C@@H](c2ccoc2)[N@H+]2[C@@H]1CC[C@@]1(CS[C@]3(C1)CC[C@H]1[C@H](C)CC[C@@H](c4ccoc4)[NH+]1[C@@H]3O)[C@@H]2O	ZINC001501058421	1072922430	/nfs/dbraw/zinc/92/24/30/1072922430.db2.gz	DYEOLAMWQVWASS-DFXIFZGQSA-N	2	1	526.743	5.943	50	0		KKAAMP
C[C@@H]1CC[C@@H](c2ccoc2)[NH+]2[C@@H]1CC[C@@]1(CS[C@]3(C1)CC[C@H]1[C@H](C)CC[C@@H](c4ccoc4)[N@@H+]1[C@@H]3O)[C@@H]2O	ZINC001501058421	1072922434	/nfs/dbraw/zinc/92/24/34/1072922434.db2.gz	DYEOLAMWQVWASS-DFXIFZGQSA-N	2	1	526.743	5.943	50	0		KKAAMP
CC(C)(C)OC[C@@H](O)C[NH+]1CCC(N2CCC(N(C(=O)C3CCCCC3)c3ccc(C(F)(F)F)cn3)CC2)CC1	ZINC000252501888	572261811	/nfs/dbraw/zinc/26/18/11/572261811.db2.gz	UKLJBKKXUYJXOV-SANMLTNESA-N	2	1	568.725	5.119	50	0		KKAAMP