UCSF

ZINC03888818

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 19 No

Popular Name: 1-[4-(Methylsulfonyl)-2-nitrophenyl]piperazine 1-[4-(Methylsulfonyl)-2-nitrophe…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1172263-55-6 , 610275-77-9 , [610275-77-9]

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) 0.09 -4.56 -59.92 2 7 1 99 286.333 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 130 - 132 Enamine Building Blocks
MP 130...132 Enamine Building Blocks
MP 172-173° Matrix Scientific
MP 287 - 289 Enamine Building Blocks
MP 287...289 Enamine Building Blocks
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% )