UCSF

ZINC40343741

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 6th, 2010 30 Yes

Popular Name: (4S)-3-(4-chlorophenyl)-5-(3-morpholinopropyl)-4-(2-thienyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one (4S)-3-(4-chlorophenyl)-5-(3-mor…

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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) 3.73 7.38 -10.46 1 6 0 61 442.972 6 ↓
Mid Mid (pH 6-8) 3.73 9.64 -43.08 2 6 1 63 443.98 6 ↓

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

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