UCSF

ZINC00409184

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 10 Yes

Popular Name: o-toluamide o-toluamide

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CAS Number: 527-85-5

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) 1.16 1.94 -7.63 2 2 0 43 135.166 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0476761A1; EP1059534A2; US4115385; US4143039; US4179511; US6004536; WO2000000195A1; WO2000006156A1; WO2000006176A1; WO2000066546A2 IBM Patent Data
PUBCHEM_PATENT_ID US5877270 IBM Patent Data

Activity (Go SEA)

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