UCSF

ZINC34677411

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 27 Yes

Popular Name: 2-[[4-[(2R)-2-hydroxyhexyl]piperazin-1-yl]methyl]-N-[(2R)-2-methylbutyl]oxazole-4-carboxamide 2-[[4-[(2R)-2-hydroxyhexyl]piper…

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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) 2.52 2.73 -44.02 3 7 1 83 381.541 11 ↓
Mid Mid (pH 6-8) 2.52 0.44 -8.04 2 7 0 82 380.533 11 ↓
Lo Low (pH 4.5-6) 2.52 2.71 -42.9 3 7 1 83 381.541 11 ↓

Activity (Go SEA)

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