UCSF

ZINC34986904

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 27 No

Popular Name: (E)-3-[1-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-(2-methylsulfanylethyl)benzimidazol-5-yl]prop-2-e (E)-3-[1-[3-(dimethylamino)-2,2-…

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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) 2.99 8.97 -61.24 3 6 1 72 391.561 9 ↓
Hi High (pH 8-9.5) 2.99 10.2 -95.22 2 6 0 74 390.553 9 ↓
Mid Mid (pH 6-8) 2.99 9.31 -104.11 4 6 2 73 392.569 9 ↓

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