UCSF

ZINC14947005

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 20 No

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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) 4.63 10.42 -4.51 0 1 0 17 272.432 0

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0133995A2; EP0133995B1; EP0208497A2; EP0208497B1; EP0246650A1; EP0246650B1; EP0345471A2; EP0345471B1; EP0423842A3; US3284505; US4170518; US4179336; US4267106; US4898694; US5001119; US5028631; US5157031; US5410040; US5656621; US5696106; US5700793; US5714 IBM Patent Data

Activity (Go SEA)

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