UCSF

ZINC34222652

Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2009 27 Yes

Download: MOL2 SDF SMILES Flexibase

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
Hi High (pH 8-9.5) 0.22 8.38 -62.24 0 7 -1 78 376.408 4

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4997943 IBM Patent Data

Activity (Go SEA)

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