UCSF

ZINC34361285

Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 30 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) -0.23 4.63 -26.74 0 11 0 137 446.478 9

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5132301; US5364848 IBM Patent Data

Activity (Go SEA)

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