UCSF

ZINC62793251

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2011 18 Yes

Popular Name: 2-(3-chloro-4-fluoro-phenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine 2-(3-chloro-4-fluoro-phenyl)-6,7…

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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) 3.38 6.98 -7.19 2 3 0 52 263.703 1 ↓
Lo Low (pH 4.5-6) 3.38 7.32 -28.25 3 3 1 53 264.711 1 ↓

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

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