UCSF

ZINC00154110

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 18 Yes

Popular Name: 1-[2-Chloro-4-methyl-5-(methylsulfonyl)phenyl]piperazine 1-[2-Chloro-4-methyl-5-(methylsu…

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CAS Numbers: 849035-65-0 , [849035-65-0]

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) 1.63 -5.99 -47.08 2 4 1 53 289.808 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 158° Fluorochem
Purity 95%+ Fluorochem
Warnings IRRITANT Matrix Scientific

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