UCSF

ZINC41529276

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 22 Yes

Popular Name: 4-(4-methylpiperazin-1-yl)-1-(2-pyridyl)pyrazolo[3,4-d]pyrimidine 4-(4-methylpiperazin-1-yl)-1-(2-…

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Download: MOL2 SDF SMILES Flexibase

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) 1.00 9.31 -48.75 1 7 1 64 296.358 2 ↓
Mid Mid (pH 6-8) 1.00 6.95 -11.98 0 7 0 63 295.35 2 ↓

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