UCSF

ZINC23908423

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2009 30 Yes

Popular Name: 2-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-6-phenyl-3H-thieno[3,2-e]pyrimidin-4-one 2-[[4-(2-hydroxyphenyl)piperazin…

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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) 3.89 7.67 -73.12 3 6 1 74 419.53 4 ↓
Mid Mid (pH 6-8) 3.89 6.24 -18.03 2 6 0 72 418.522 4 ↓
Mid Mid (pH 6-8) 3.89 9.81 -54.37 3 6 1 74 419.53 4 ↓

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

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