UCSF

ZINC00068768

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 Yes

Popular Name: methyl 2-[(ethoxycarbonyl)amino]benzoate methyl 2-[(ethoxycarbonyl)amino]…

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CAS Numbers: , 83846-67-7

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) 2.55 1.64 -8.22 1 5 0 64 223.228 5 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4849431; US4942169; US5039681; US5118684; US5306720; US5424318; US5654306 IBM Patent Data

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