UCSF

ZINC69485441

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 24 Yes

Popular Name: 2-[5-[(1-ethyl-4-fluoro-benzimidazol-2-yl)methylsulfanyl]tetrazol-1-yl]-N,N-dimethyl-ethanamine 2-[5-[(1-ethyl-4-fluoro-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) 2.02 8.97 -51.18 1 7 1 66 350.447 7 ↓
Mid Mid (pH 6-8) 2.02 6.5 -14.05 0 7 0 65 349.439 7 ↓
Lo Low (pH 4.5-6) 2.02 9.39 -91.57 2 7 2 67 351.455 7 ↓

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

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