UCSF

ZINC67947994

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 24 Yes

Popular Name: N-[2-[1-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]ethyl]acetamide N-[2-[1-[2-(6-methyl-1H-benzimid…

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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) 2.17 8.15 -49.58 3 5 1 62 327.452 6 ↓
Hi High (pH 8-9.5) 2.17 5.85 -14.54 2 5 0 61 326.444 6 ↓
Lo Low (pH 4.5-6) 2.17 8.56 -111.39 4 5 2 63 328.46 6 ↓

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

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