CC(C)[C@H](N)C(=O)OCCOCn1cnc2c(=O)[nH]c(N)nc21	ZINC000001530713	70/29/47/275702947	HDOVUKNUBWVHOX-QMMMGPOBSA-N	0	324.341	DB	-0.798	1	Anodyne	mid	DBAAMN	CC(C)[C@H](N)C(=O)OCCOCn1cnc2c(=O)[nH]c(N)nc21	fda
CC(C)[C@H](N)C(=O)OCCOCn1cnc2c(=O)[nH]c(N)nc21	ZINC000001530713	70/29/46/275702946	HDOVUKNUBWVHOX-QMMMGPOBSA-N	1	324.341	DB	-0.798	0	Anodyne	ref	DBAARO	CC(C)[C@H]([NH3+])C(=O)OCCOCn1cnc2c(=O)[nH]c(N)nc21	fda
CC(=O)Nc1nc2c(ncn2COCCOC(C)=O)c(=O)[nH]1	ZINC000001800215	89/72/35/180897235	VBHLKZHSCMQLTI-UHFFFAOYSA-N	0	309.282	DB	-0.385	0	Anodyne	ref	DBAARN	CC(=O)Nc1nc2c(ncn2COCCOC(C)=O)c(=O)[nH]1	in-vitro
Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F	ZINC000003798247	04/58/42/181045842	WDDPHFBMKLOVOX-AYQXTPAHSA-N	0	303.681	DB	-0.349	0	Anodyne	ref	DBAARN	Nc1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F	fda
OC[C@H]1O[C@@H](n2cnc3c(Cl)nc(Cl)nc32)[C@H](O)[C@@H]1O	ZINC000021297825	64/68/40/190646840	HJXWZGVMHDPCRS-UUOKFMHZSA-N	0	321.12	DB	-0.255	0	Anodyne	ref	DBAARN	OC[C@H]1O[C@@H](n2cnc3c(Cl)nc(Cl)nc32)[C@H](O)[C@@H]1O