UCSF

ZINC12402477

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 31 Yes

Popular Name: (2S)-2-hydroxy-5,5-dimethyl-1-(2-quinolyl)-2-(trifluoromethyl)-6H-benzo[g]indolizin-3-one (2S)-2-hydroxy-5,5-dimethyl-1-(2…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.93 0.57 -11.9 1 4 0 53 424.422 2 ↓
Lo Low (pH 4.5-6) 3.93 0.65 -28.39 2 4 1 55 425.43 2 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )