UCSF

ZINC31559662

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 20 No

Popular Name: (N-Morpholino-2 ethyl)-2 nitro-5 benzimidazole [French]; 2-(2-Morpholinoethyl)-5-nitrobenzimidazole; Benzimidazole, 2-(2-morpholinoethyl)-5-nitro-; LS-33084 (N-Morpholino-2 ethyl)-2 nitro-5…

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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) 1.52 3.83 -9.41 1 7 0 87 276.296 4 ↓
Mid Mid (pH 6-8) 1.52 6.11 -52.2 2 7 1 88 277.304 4 ↓
Mid Mid (pH 6-8) 1.52 6.11 -50.98 2 7 1 88 277.304 4 ↓

Activity (Go SEA)

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