UCSF

ZINC43210598

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 34 No

Popular Name: (1R,3R,3aS,6aS)-3-[(1R)-1-hydroxyethyl]-1-(4-hydroxy-3-methoxy-phenyl)-5-(3-nitrophenyl)-4,6-dioxo-1 (1R,3R,3aS,6aS)-3-[(1R)-1-hydrox…

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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) -1.16 4.32 -45.66 4 12 0 190 471.422 6 ↓
Hi High (pH 8-9.5) -1.16 3.38 -51.8 3 12 -1 185 470.414 6 ↓

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