UCSF

ZINC15952999

Substance Information

In ZINC since Heavy atoms Benign functionality
August 4th, 2008 25 No

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 4.3 -11.01 2 6 0 96 364.781 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0460950A1; EP0460950B1; EP0606044A1; EP0788356A2; EP0810860A1; EP0823429A1; EP0823429B1; EP0889042A1; EP1023315A1; US4166764; US4228079; US4707492; US5597846; US5650430; US5674892; US5728726; US5731343; US5795910; US5905089; US5977165; US6017949; US6093 IBM Patent Data

Activity (Go SEA)

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