UCSF

ZINC04737147

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 28 Yes

Popular Name: 8-benzylsulfanyl-N-(3-chlorophenyl)-3-oxo-2,6,7,9-tetrazabicyclo[4.3.0]nona-7,9-diene-5-carboxamide 8-benzylsulfanyl-N-(3-chlorophen…

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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) 3.05 10.49 -12.06 2 7 0 89 413.89 5 ↓
Mid Mid (pH 6-8) 3.23 8.45 -45.63 1 7 -1 95 412.882 5 ↓

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

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