UCSF

ZINC37290919

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Substance Information

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

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

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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) 2.46 7.91 -12.48 2 5 0 66 286.31 2 ↓
Mid Mid (pH 6-8) 2.46 8.37 -29.59 3 5 1 67 287.318 2 ↓

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

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