UCSF

ZINC20996111

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2008 30 Yes

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

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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) 2.79 7.15 -45.41 2 6 1 63 405.522 7 ↓
Mid Mid (pH 6-8) 2.79 7.21 -44.92 2 6 1 63 405.522 7 ↓
Mid Mid (pH 6-8) 2.79 4.83 -8.38 1 6 0 62 404.514 7 ↓

Activity (Go SEA)

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