smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCCCCC[Si](Cl)(Cl)Cl 169806119 LFXJGGDONSCPOF-UHFFFAOYSA-N 219.615 4.222 70 50 BIIA in-vitro F[B-](F)(F)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1c1ccccc1 514250963 JPIWJGGOFRFKBT-RVMXOQNASA-N 239.069 4.418 70 50 BIIA C[Si](C)(Cl)CC[C@H]1CC=CCC1 170156850 XQRFNPGYTWWODZ-JTQLQIEISA-N 202.801 4.177 70 50 BIIA CC(C)(C)[C@H]1CC=C([B-](F)(F)F)CC1 238152126 XPNPNFMAVJRPBM-QMMMGPOBSA-N 205.052 4.146 70 50 BIIA C[Si](C)(Cl)CC[C@H]1C[C@@H]2C=C[C@H]1C2 169876870 UFEKKYNQUHJSEC-VWYCJHECSA-N 214.812 4.033 70 50 BIIA c1ccc(CB2C3CCCC2CCC3)cc1 169746801 IQRBNRFCRAJXJF-UHFFFAOYSA-N 212.145 4.371 70 50 BIIA C[Si](C)(Cl)CCCCc1ccccc1 196090576 SRTCQNMBBTZICB-UHFFFAOYSA-N 226.823 4.453 70 50 BIIA C=CCCCCC[Si](Cl)(Cl)Cl 197069029 OTRIVALIQLJPLQ-UHFFFAOYSA-N 231.626 4.388 70 50 BIIA Cc1ccc(N=C=Nc2ccc(C)cc2)cc1 8442219 BOSWPVRACYJBSJ-UHFFFAOYSA-N 222.291 4.441 70 50 BIIA in-vitro CC(C)(C)[C@@H]1CC=C([B-](F)(F)F)CC1 238089402 XPNPNFMAVJRPBM-MRVPVSSYSA-N 205.052 4.146 70 50 BIIA CCCCCCCCCC[SiH2]c1ccccc1 169817685 DMZKNSOBUZQOGF-UHFFFAOYSA-N 248.486 4.040 70 50 BIIA CC1=CC[C@H]([C@H](C)C[B-](F)(F)F)CC1 575442228 TUZRQLJOEMQSHA-ZJUUUORDSA-N 205.052 4.216 70 50 BIIA F[B-](F)(F)[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1c1ccccc1 514250964 JPIWJGGOFRFKBT-WUHRBBMRSA-N 239.069 4.418 70 50 BIIA CC1=CC[C@@H]([C@@H](C)C[B-](F)(F)F)CC1 575442226 TUZRQLJOEMQSHA-VHSXEESVSA-N 205.052 4.216 70 50 BIIA C[Si](C)(Cl)CC[C@@H]1CC=CCC1 170156852 XQRFNPGYTWWODZ-SNVBAGLBSA-N 202.801 4.177 70 50 BIIA F[B-](F)(F)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1c1ccccc1 514250965 JPIWJGGOFRFKBT-ZDEQEGDKSA-N 239.069 4.418 70 50 BIIA CC(C)c1cccc(/C=C/[B-](F)(F)F)c1 261508519 UDAUDCMUFGKIPG-VOTSOKGWSA-N 213.031 4.210 70 50 BIIA CCCCCCCCC#C[B-](F)(F)F 195863122 OQQUGGYWNYDYKM-UHFFFAOYSA-N 205.052 4.127 70 50 BIIA in-vitro CC(C)C[SiH](CC(C)C)CC(C)C 170174093 BORQTRQJFUNMBC-UHFFFAOYSA-N 200.442 4.182 70 50 BIIA C[Si](C)(Cl)CC[C@@H]1C[C@@H]2C=C[C@H]1C2 169876866 UFEKKYNQUHJSEC-OUAUKWLOSA-N 214.812 4.033 70 50 BIIA Cc1ccccc1N=C=Nc1ccccc1C 31350251 JCNCSCMYYGONLU-UHFFFAOYSA-N 222.291 4.441 70 50 BIIA CC1=CC[C@@H]([C@H](C)C[B-](F)(F)F)CC1 575442213 TUZRQLJOEMQSHA-NXEZZACHSA-N 205.052 4.216 70 50 BIIA F[B-](F)(F)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1c1ccccc1 514250962 JPIWJGGOFRFKBT-CYDGBPFRSA-N 239.069 4.418 70 50 BIIA CC(C)[SiH](O[SiH](C(C)C)C(C)C)C(C)C 169747822 MQRXZVLOOXQGLF-UHFFFAOYSA-N 246.543 4.091 70 50 BIIA F[B-](F)(F)CCCSc1ccccc1 195942920 XESBKZHMQFREGR-UHFFFAOYSA-N 219.060 4.016 70 50 BIIA CC1=C(C)C([Si](C)(C)Cl)C(C)=C1C 170173254 QTMBNCMQGRJAAA-UHFFFAOYSA-N 214.812 4.487 70 50 BIIA in-vitro CC1=CC[C@H]([C@@H](C)C[B-](F)(F)F)CC1 575442225 TUZRQLJOEMQSHA-UWVGGRQHSA-N 205.052 4.216 70 50 BIIA