UCSF

ZINC12402066

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 29 No

Popular Name: (1R,3R,3aR,6aS)-1-(3,5-dichloro-2-hydroxy-phenyl)-3-methyl-4,6-dioxo-5-phenyl-1,2,3a,6a-tetrahydropy (1R,3R,3aR,6aS)-1-(3,5-dichloro-…

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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) 1.21 7.12 -28.56 3 7 0 114 435.263 3 ↓
Hi High (pH 8-9.5) 1.21 6.1 -102.2 1 7 -2 113 433.247 3 ↓

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