UCSF

ZINC53619562

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 26 Yes

Popular Name: N-[2-(1H-imidazol-5-yl)ethyl]-3-[(3R,4S)-7-methoxy-4-methyl-2-oxo-chroman-3-yl]propanamide N-[2-(1H-imidazol-5-yl)ethyl]-3-…

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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) 1.68 7.87 -45.97 3 7 1 95 358.418 7 ↓
Mid Mid (pH 6-8) 1.68 7.38 -19.69 2 7 0 93 357.41 7 ↓

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

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