UCSF

ZINC37304322

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 23rd, 2009 21 Yes

Popular Name: 1,3-dimethyl-N-(1-prop-2-ynyl-4-piperidyl)pyrazolo[3,4-b]pyridin-5-amine 1,3-dimethyl-N-(1-prop-2-ynyl-4-…

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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) 2.27 5.16 -9.28 1 5 0 46 283.379 3 ↓
Mid Mid (pH 6-8) 2.27 7.44 -46.46 2 5 1 47 284.387 3 ↓

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

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