UCSF

ZINC53629581

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 20 No

Popular Name: (2R,3S)-3-chloro-N-[2-(1H-imidazol-5-yl)ethyl]-2,3-dihydrobenzothiophene-2-carboxamide (2R,3S)-3-chloro-N-[2-(1H-imidaz…

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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) 1.87 7.43 -42.46 3 4 1 59 308.814 4 ↓
Mid Mid (pH 6-8) 1.87 6.96 -14.24 2 4 0 58 307.806 4 ↓

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

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