UCSF

ZINC36613293

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2009 33 Yes

Popular Name: [1,3-dimethyl-6-(p-tolyl)pyrazolo[3,4-b]pyridin-4-yl]-[4-(2-pyridylmethyl)piperazin-1-yl]methanone [1,3-dimethyl-6-(p-tolyl)pyrazol…

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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) 2.37 10.1 -13.47 0 7 0 67 440.551 4 ↓
Mid Mid (pH 6-8) 2.37 12.32 -55.88 1 7 1 68 441.559 4 ↓
Mid Mid (pH 6-8) 2.37 10.1 -44.79 1 7 1 68 441.559 4 ↓
Lo Low (pH 4.5-6) 2.37 12.31 -133.92 2 7 2 70 442.567 4 ↓

Activity (Go SEA)

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