UCSF

ZINC41070515

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2010 27 No

Popular Name: 5,5-dioxo-1-phenyl-N-(3-pyridylmethyl)-6,7-dihydro-4H-thiopyrano[4,3-c]pyrazole-3-carboxamide 5,5-dioxo-1-phenyl-N-(3-pyridylm…

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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) 0.83 4.25 -18.84 1 7 0 94 382.445 4 ↓
Lo Low (pH 4.5-6) 0.83 4.71 -47.6 2 7 1 95 383.453 4 ↓

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

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