UCSF

ZINC55108075

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 31 Yes

Popular Name: 2-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-N-[(1R)-1-(4-pyridyl)propyl]oxazole-4-carboxamide 2-[[4-(2-fluorophenyl)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) 1.68 5.45 -9.68 1 7 0 74 423.492 7 ↓
Lo Low (pH 4.5-6) 1.68 8.16 -90.36 3 7 2 77 425.508 7 ↓

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