UCSF

ZINC69559689

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2011 24 Yes

Popular Name: N-[(1-ethyl-4-fluoro-benzimidazol-2-yl)methyl]-N-[(1-methylpyrazol-4-yl)methyl]propan-2-amine N-[(1-ethyl-4-fluoro-benzimidazo…

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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) 2.35 9.93 -44.8 1 5 1 40 330.431 6 ↓
Hi High (pH 8-9.5) 2.35 7.41 -14.75 0 5 0 39 329.423 6 ↓

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

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