UCSF

ZINC33497883

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2009 36 No

Popular Name: (1R,3R,3aS,6aS)-1-(4-acetoxyphenyl)-3-[(1R)-1-methylpropyl]-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-te (1R,3R,3aS,6aS)-1-(4-acetoxyphen…

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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) 0.95 11.4 -48.46 2 11 0 166 495.488 8 ↓
Hi High (pH 8-9.5) 0.95 10.45 -50.38 1 11 -1 162 494.48 8 ↓

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