UCSF

ZINC54794294

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 8th, 2010 20 Yes

Popular Name: 1-isopropyl-N-[(4-methyl-1H-imidazol-5-yl)methyl]pyrazolo[3,4-b]pyridin-5-amine 1-isopropyl-N-[(4-methyl-1H-imid…

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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) 1.38 6.33 -43.2 3 6 1 73 271.348 4 ↓
Mid Mid (pH 6-8) 1.38 5.86 -11.44 2 6 0 71 270.34 4 ↓

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

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