UCSF

ZINC04737153

Draw Identity 99% 90% 80% 70%

Substance Information

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

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

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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) 2.80 10.87 -10.74 2 7 0 89 393.472 5 ↓
Mid Mid (pH 6-8) 2.98 8.82 -44.86 1 7 -1 95 392.464 5 ↓

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

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