UCSF

ZINC04216123

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 15 No

Popular Name: N-Methyl-N-[4-(methylsulfonyl)-2-nitrophenyl]amine N-Methyl-N-[4-(methylsulfonyl)-2…

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CAS Numbers: 30388-44-4 , [30388-44-4]

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) 0.55 1.71 -14.79 1 6 0 92 230.245 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 188 - 190° Fluorochem
MP 188-190° Matrix Scientific
MP 193° Matrix Scientific
Purity 95% Fluorochem
Warnings Irritant Matrix Scientific

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