UCSF

ZINC01545437

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 12 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) 4.09 6.54 -39.74 3 1 1 28 172.336 9

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0322209A1; EP0322209B1; EP0626942A1; EP0626942B1; US4260497; US4954339; US5514683; WO1993016982A1 IBM Patent Data
PUBCHEM_PATENT_ID EP0747383A2; EP0747383A3; EP0801069A1; EP0804441A1; EP0806426A1; WO1993025557A1 IBM Patent Data
PUBCHEM_PATENT_ID EP0747383A2; EP0747383A3; EP0801069A1; EP0804441A1; EP0806426A1; WO1993025557A1; WO1996022296A1; WO1998045300A1 IBM Patent Data

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