UCSF

ZINC53629878

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 24 Yes

Popular Name: (2S)-N-[2-(1H-imidazol-4-yl)ethyl]-2-pyrrol-1-yl-2,3-dihydro-1,3-benzothiazole-6-carboxamide (2S)-N-[2-(1H-imidazol-4-yl)ethy…

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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) 1.81 7.89 -47.39 4 6 1 76 340.432 5 ↓
Mid Mid (pH 6-8) 1.81 7.37 -19.4 3 6 0 75 339.424 5 ↓

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

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