UCSF

ZINC09130588

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 9th, 2007 30 No

Popular Name: N-(8-benzyl-3,3-dioxo-3$l^{6},6-dithia-8-azabicyclo[3.3.0]oct-7-ylidene)-3,4-dimethoxy-benzamide N-(8-benzyl-3,3-dioxo-3$l^{6},6-…

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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) 1.95 6.45 -28.65 0 7 0 85 446.55 5 ↓
Lo Low (pH 4.5-6) 1.95 7.26 -51.75 1 7 1 87 447.558 5 ↓
Lo Low (pH 4.5-6) 1.95 6.6 -49.14 1 7 1 87 447.558 5 ↓

Activity (Go SEA)

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