UCSF

ZINC04231705

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 17 Yes

Popular Name: (4-Methoxy-phenyl)-(2-pyridin-2-yl-ethyl)-amine (4-Methoxy-phenyl)-(2-pyridin-2-…

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CAS Numbers: 1185300-45-1 , 55496-58-7

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) 2.49 5.38 -7.1 1 3 0 34 228.295 5 ↓
Lo Low (pH 4.5-6) 2.49 5.74 -35.47 2 3 1 35 229.303 5 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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