UCSF

ZINC04737148

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 2nd, 2006 29 Yes

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

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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) 2.43 8.95 -13.4 2 8 0 98 409.471 6 ↓
Mid Mid (pH 6-8) 2.61 6.97 -50.91 1 8 -1 104 408.463 6 ↓

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

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