UCSF

ZINC04413492

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2005 17 Yes

Popular Name: 2-[(pyridin-3-ylmethyl)amino]benzoic acid 2-[(pyridin-3-ylmethyl)amino]ben…

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CAS Number: 282719-60-2

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) 2.00 5.19 -53.92 1 4 -1 65 227.243 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 189 - 191 Enamine Building Blocks
MP 189...191 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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