UCSF

ZINC04344094

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 21 Yes

Popular Name: 5-butyl-6-hydroxy-1-phenyl-1,7-dihydro-4H-pyrazolo[3,4-b]pyridin-4-one 5-butyl-6-hydroxy-1-phenyl-1,7-d…

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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) 3.24 6.91 -42.49 1 5 -1 74 282.323 4 ↓
Mid Mid (pH 6-8) 3.69 -1.74 -14.59 2 5 0 71 283.331 4 ↓

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

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