UCSF

ZINC65494377

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 27 No

Popular Name: (2S,8R,8aS)-8-[(3R)-2-oxo-3H-quinolin-3-yl]-2-pyrrolidin-1-yl-2,4,5,7,8,8a-hexahydrothiazolo[4,5-c]a (2S,8R,8aS)-8-[(3R)-2-oxo-3H-qui…

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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) 1.79 2.46 -39.97 2 6 1 76 383.497 2 ↓
Lo Low (pH 4.5-6) 1.79 4.54 -82.86 3 6 2 77 384.505 2 ↓

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

No pre-computed analogs available. Try a structural similarity search.