UCSF

ZINC19851036

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 14 Yes

Popular Name: methyl amino(3,4-dichlorophenyl)acetate hydrochloride methyl amino(3,4-dichlorophenyl)…

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CAS Numbers: 1078611-21-8 , 185110-25-2 , [1078611-21-8]

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) 0.57 4 -8.07 2 3 0 52 234.082 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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