UCSF

ZINC59250592

Substance Information

In ZINC since Heavy atoms Benign functionality
February 28th, 2011 14 No

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Vendors

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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) 2.52 2.62 -8.14 2 3 0 49 201.31 9

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0421441A2; EP0421441B1; EP0853107A1; US5120738; US5693129 IBM Patent Data

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