UCSF

ZINC01385894

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 22 Yes

Popular Name: 2-fluoro-N-[1-(5-methyl-1H-1,3-benzimidazol-2-yl)ethyl]benzenecarboxamide 2-fluoro-N-[1-(5-methyl-1H-1,3-b…

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CAS Number: 338410-65-4

Other Names:

MFCD00244032

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) 3.23 7.01 -12.38 2 4 0 58 297.333 3 ↓
Lo Low (pH 4.5-6) 3.23 7.43 -37.44 3 4 1 59 298.341 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 194 - 196 KeyOrganics

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Rings

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

No pre-computed analogs available. Try a structural similarity search.