UCSF

ZINC13403612

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 21 Yes

Popular Name: 6-allyl-5-methyl-2-(m-tolyl)pyrazolo[5,1-b]pyrimidin-7-ol 6-allyl-5-methyl-2-(m-tolyl)pyra…

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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) 3.31 9 -22.99 1 4 0 50 279.343 3 ↓
Hi High (pH 8-9.5) 3.77 7.59 -52.49 0 4 -1 53 278.335 3 ↓

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

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