UCSF

ZINC59286958

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2011 22 No

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Annotations

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) 8.74 13.48 -1.7 1 1 0 20 310.566 18

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0300397A2; US5030733; US5145844 IBM Patent Data

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