UCSF

ZINC39648260

Substance Information

In ZINC since Heavy atoms Benign functionality
March 2nd, 2010 8 Yes

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) 0.67 1.47 -2.52 0 2 0 18 116.16 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0177913A1; EP0393256A1; US4624696; US4835177; US4894392; US4923852; US4925831 IBM Patent Data
PUBCHEM_PATENT_ID EP0572669A1; EP0798298A1; US5446031; US5843973 IBM Patent Data
PUBCHEM_PATENT_ID EP0945764A2; EP0955563A1; US6153349 IBM Patent Data

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