UCSF

ZINC49570051

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 21 Yes

Popular Name: 7-(5-bromo-2-methoxy-phenyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-amine 7-(5-bromo-2-methoxy-phenyl)-5,6…

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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) 3.32 8.65 -11.52 2 5 0 66 347.216 2 ↓
Mid Mid (pH 6-8) 3.32 9.12 -26.46 3 5 1 67 348.224 2 ↓

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

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