UCSF

ZINC34343675

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2009 33 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) -0.12 4.71 -68.25 3 12 -1 172 509.571 8

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4918070; US5049665 IBM Patent Data

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