UCSF

ZINC15045247

Annotations

Vendors

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) -0.96 -0.45 -10.89 2 4 0 62 85.066 0

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
PUBCHEM_PATENT_ID EP0202046A1; EP0203722A1; EP0223937A1; EP0280224A2; EP0280224B1; EP0301877A1; EP0301877B1; EP0327239A1; EP0327239B1; EP0610334A1; EP0610334B1; EP0628556A1; EP0657435A2; EP0657435A3; EP0698015A1; EP0708775A1; EP0708775B1; EP0733033A1; EP0733033B1; EP075194 IBM Patent Data
PUBCHEM_PATENT_ID EP0311135B1; EP0751944A1; EP0751944B1; US4859230; US5955481; WO1996011196A1; WO1996026207A1 IBM Patent Data
PUBCHEM_PATENT_ID EP0751944A1; EP0751944B1; EP0889881A1; US5955481; US6153616; WO1995026347A1; WO1996011196A1; WO1996026207A1 IBM Patent Data

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

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