UCSF

ZINC37288886

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 6-ethyl-1-(1-methyl-4-piperidyl)pyrazolo[3,4-b]pyridine-4-carboxylic 6-ethyl-1-(1-methyl-4-piperidyl)…

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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) 1.73 8.8 -69.07 1 6 0 75 288.351 3 ↓
Hi High (pH 8-9.5) 1.73 6.4 -45.36 0 6 -1 74 287.343 3 ↓

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

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