UCSF

ZINC43208770

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2010 12 Yes

Other Names:

MFCD09801155

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) 3.19 6.71 -3.18 0 1 0 9 162.232 4

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0319986B1; EP0711760A1; EP0760369A1; US3969384; US3995054; US5235061; US5792867; US6130332 IBM Patent Data

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