UCSF

ZINC39340214

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 28 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) 5.74 7.96 -14.67 1 6 0 76 465.786 7

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US3991069; US3993646; US4009159; US4036847; US4071527; US4193917; US4267340; US4410458; US4435321; US4931555 IBM Patent Data

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