UCSF

ZINC04132190

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2005 16 No

Popular Name: 1-(2-Chloro-6-nitrophenyl)piperazine 1-(2-Chloro-6-nitrophenyl)pipera…

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CAS Numbers: , 332023-12-8 , 5749-39-3 , [5749-39-3] , [57497-39-9]

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) 1.88 5.55 -43.4 2 5 1 66 242.686 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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