UCSF

ZINC00268963

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 16 Yes

Popular Name: 1-(3,4-Dimethoxy-benzylamino)-propan-2-oloxalate 1-(3,4-Dimethoxy-benzylamino)-pr…

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CAS Numbers: 1185298-27-4 , 510740-02-0

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) 0.87 1.98 -43.96 3 4 1 55 226.296 6 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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