UCSF

ZINC03848212

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 17 Yes

Popular Name: N-phenylbicyclo[4.2.0]octa-1,3,5-triene-7-carboxamide N-phenylbicyclo[4.2.0]octa-1,3,5…

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Download: MOL2 SDF SMILES Flexibase

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) 2.70 -0.03 -8.98 1 2 0 29 223.275 2 ↓

Vendor Notes

Note Type Comments Provided By
mp 160 - 162 MolMall (formerly Molecular Diversity Preservation International)

Activity (Go SEA)

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