UCSF

ZINC37323667

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 21 No

Popular Name: 3-(1-tert-butylbenzimidazol-2-yl)-4,5-dimethyl-thiophen-2-amine 3-(1-tert-butylbenzimidazol-2-yl…

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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) 3.99 7.58 -11.89 1 3 0 42 299.443 2 ↓
Mid Mid (pH 6-8) 4.59 7.6 -8.85 2 3 0 44 299.443 2 ↓
Lo Low (pH 4.5-6) 4.59 8.05 -20.29 3 3 1 45 300.451 2 ↓

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