UCSF

ZINC19594752

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2008 31 Yes

Popular Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-ethyl-N-(4-pyridylmethyl)oxazole-4-carboxamide 2-[(4-benzylpiperazin-1-yl)methy…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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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) 1.72 8.9 -50.03 1 7 1 67 420.537 8 ↓
Mid Mid (pH 6-8) 1.72 8.85 -46.86 1 7 1 67 420.537 8 ↓
Mid Mid (pH 6-8) 1.72 6.52 -10.49 0 7 0 66 419.529 8 ↓
Lo Low (pH 4.5-6) 1.72 9.34 -93.81 2 7 2 68 421.545 8 ↓
Lo Low (pH 4.5-6) 1.72 9.61 -82.79 2 7 2 68 421.545 8 ↓

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