UCSF

ZINC34677446

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 30 Yes

Popular Name: 2-[[4-[(2S)-2-hydroxy-3-morpholino-propyl]piperazin-1-yl]methyl]-N-isopentyl-oxazole-4-carboxamide 2-[[4-[(2S)-2-hydroxy-3-morpholi…

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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) 0.48 -1.17 -47.05 3 9 1 96 424.566 10 ↓
Mid Mid (pH 6-8) 0.48 1.19 -97.07 4 9 2 97 425.574 10 ↓
Mid Mid (pH 6-8) 0.48 -3.45 -10.19 2 9 0 94 423.558 10 ↓

Activity (Go SEA)

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