UCSF

ZINC39384601

Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2010 13 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) -0.01 -1.62 -4.87 2 4 0 51 187.239 1

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4360531; US4466977 IBM Patent Data

Activity (Go SEA)

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