UCSF

ZINC03164844

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 10 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) 0.08 -0.21 -39.06 3 3 1 46 146.21 6

Vendor Notes

Note Type Comments Provided By
BP 118-119/23 Torr Matrix Scientific
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID US4851490; US4868263; US4886617; US4898684; US4906383; US4913880; US4980433 IBM Patent Data

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