UCSF

ZINC03888907

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 17 No

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

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CAS Numbers: 849035-93-4 , [849035-93-4]

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) -0.64 -6.62 -65.04 4 7 1 119 260.295 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 144 - 145° Fluorochem
MP 144-145° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings Irritant Matrix Scientific

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