UCSF

ZINC04245371

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Substance Information

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

Popular Name: (4-Aminophenyl)(1-azepanyl)methanone (4-Aminophenyl)(1-azepanyl)metha…

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CAS Numbers: , 5157-66-4

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) 1.39 5.14 -9.76 2 3 0 46 218.3 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 133 - 135 Enamine Building Blocks
MP 133...135 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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