UCSF

ZINC34677607

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 35 Yes

Popular Name: 2-[[4-[(2R)-2-hydroxy-3-morpholino-propyl]piperazin-1-yl]methyl]-N-[2-(2-methoxyphenyl)ethyl]oxazole 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) 0.64 -0.34 -49.5 3 10 1 105 488.609 11 ↓
Mid Mid (pH 6-8) 0.64 1.94 -99.55 4 10 2 106 489.617 11 ↓
Mid Mid (pH 6-8) 0.64 -2.6 -13.26 2 10 0 104 487.601 11 ↓

Activity (Go SEA)

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