UCSF

ZINC00134623

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

Download: MOL2 SDF SMILES Flexibase

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) 3.40 1.38 -7.35 0 2 0 26 224.259 1

Vendor Notes

Note Type Comments Provided By
Patent Database Links EP1440688; US2005014819 ChEBI

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