UCSF

ZINC00091809

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Substance Information

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

Popular Name: (4-nitrophenyl)(piperazino)methanone (4-nitrophenyl)(piperazino)metha…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 202819-51-0 , 72141-41-4 , 92141-41-4 , [72141-41-4]

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) 0.16 4.7 -55.74 2 6 1 83 236.251 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 151 - 154 KeyOrganics
melting_point 158 - 161 KeyOrganics
MP 158-161° Matrix Scientific
MP 284 - 286 Enamine Building Blocks
MP 284...286 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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