UCSF

ZINC34677651

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 31 Yes

Popular Name: 2-[[4-[(2R)-2-hydroxy-3-morpholino-propyl]piperazin-1-yl]methyl]-N,N-dipropyl-oxazole-4-carboxamide 2-[[4-[(2R)-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) 0.83 2.42 -48.83 2 9 1 87 438.593 11 ↓
Mid Mid (pH 6-8) 0.83 4.75 -99.44 3 9 2 88 439.601 11 ↓
Mid Mid (pH 6-8) 0.83 0.15 -10.3 1 9 0 86 437.585 11 ↓

Activity (Go SEA)

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