UCSF

ZINC24023127

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 12th, 2009 31 Yes

Popular Name: N-[(R)-(3,5-dimethoxyphenyl)-(1-methylimidazol-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carb N-[(R)-(3,5-dimethoxyphenyl)-(1-…

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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) 2.29 7.22 -16.23 1 8 0 84 423.469 6 ↓
Lo Low (pH 4.5-6) 2.29 8.51 -37.6 2 8 1 85 424.477 6 ↓

Activity (Go SEA)

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