UCSF

ZINC16051849

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2008 9 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) -0.82 -6.32 -8.54 3 4 0 70 134.131 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0345104A2; EP0345104B1; EP0348446A1; EP0348446B1; EP0532668B1; EP0636372A1; EP0636372B1; US4880784; US5041426; US5157116; US5504078; WO1989005817A1; WO1991018915A1; WO1994008456A1; WO1996006845A1; WO1997031008A1; WO1997046569A2; WO1999015465A1 IBM Patent Data
PUBCHEM_PATENT_ID EP0443312A2; EP0443312B1; US4713383; US4897345; US5013737 IBM Patent Data

Activity (Go SEA)

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