UCSF

ZINC33935647

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2009 33 No

Popular Name: (1R,3S,3aS,6aS)-3-[(1S)-1-hydroxyethyl]-1-(2-methoxyphenyl)-5-(3-nitrophenyl)-4,6-dioxo-1,2,3a,6a-te (1R,3S,3aS,6aS)-3-[(1S)-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) -0.49 7.07 -35.16 3 11 0 169 455.423 6 ↓
Hi High (pH 8-9.5) -0.49 6.86 -46.39 2 11 -1 165 454.415 6 ↓

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