UCSF

ZINC63720305

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 18 No

Popular Name: (6S)-5-(3-chlorophenyl)-6-sulfanyl-6H-pyrazolo[3,4-d]pyrimidin-4-one (6S)-5-(3-chlorophenyl)-6-sulfan…

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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) 2.31 4.27 -37.5 0 5 -1 58 277.716 1 ↓
Mid Mid (pH 6-8) 2.31 3.74 -5.98 0 5 0 58 278.724 1 ↓

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

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