UCSF

ZINC04478359

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2005 13 Yes

Popular Name: (Methyl-pyridin-2-ylmethyl-amino)-acetic acid (Methyl-pyridin-2-ylmethyl-amino…

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CAS Numbers: 1185304-77-1 , 1315173-05-7 , 669083-52-7 , [669083-52-7]

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) -1.10 0.6 -37.81 1 4 0 57 180.207 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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