UCSF

ZINC42143698

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 18 Yes

Popular Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylaniline 4-(1-methylpyrazolo[3,4-d]pyrimi…

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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) 1.42 5.56 -8.43 2 5 0 70 257.322 2 ↓

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

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