UCSF

ZINC11735091

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 6th, 2008 13 Yes

Popular Name: (2-methyl-1H-benzimidazol-1-yl)acetonitrile (2-methyl-1H-benzimidazol-1-yl)a…

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CAS Number: 54980-87-9

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) 1.37 6.3 -14.11 0 3 0 42 171.203 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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