UCSF

ZINC55108045

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 26 No

Popular Name: N-ethyl-N-[2-(5-methyl-1H-benzimidazol-2-yl)ethyl]-2-[(4S,6R)-6-methyl-2-thioxo-hexahydropyrimidin-4 N-ethyl-N-[2-(5-methyl-1H-benzim…

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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) 3.78 8.27 -28.39 3 6 0 73 373.526 6 ↓
Mid Mid (pH 6-8) 3.78 8.69 -43.51 4 6 1 74 374.534 6 ↓

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

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