UCSF

ZINC15416126

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2008 11 No

Popular Name: 3,4-Dihydroquinolin-1(2H)-amine 3,4-Dihydroquinolin-1(2H)-amine

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CAS Numbers: 1044517-80-7 , 5825-45-6 , [5825-45-6]

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) 1.94 3.82 -3.56 2 2 0 29 148.209 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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