UCSF

ZINC23909393

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: 2-[[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]methyl]-5-(2-furyl)-3H-thieno[3,2-e]pyrimidin-4-one 2-[[4-(5-chloro-2-methyl-phenyl)…

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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) 4.16 10.56 -78.52 2 6 1 67 441.964 4 ↓
Mid Mid (pH 6-8) 4.16 9.09 -16.77 1 6 0 65 440.956 4 ↓
Mid Mid (pH 6-8) 4.16 13.07 -61.08 2 6 1 67 441.964 4 ↓

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

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