UCSF

ZINC19842022

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 26 Yes

Popular Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-sec-butyl-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) 2.20 5.06 -46.85 2 6 1 63 357.478 7 ↓
Mid Mid (pH 6-8) 2.20 5 -44.95 2 6 1 63 357.478 7 ↓
Mid Mid (pH 6-8) 2.20 2.68 -8.74 1 6 0 62 356.47 7 ↓

Activity (Go SEA)

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