UCSF

ZINC00169244

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 19 Yes

Popular Name: 1-[(4-fluorophenyl)sulfonyl]-4-piperidinecarboxylic acid 1-[(4-fluorophenyl)sulfonyl]-4-p…

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CAS Numbers: 112632-96-9 , 326907-70-4

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) 1.43 -3.06 -51.99 0 5 -1 77 286.304 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 174 - 176 KeyOrganics
MP 174-176° Fluorochem
Warnings IRRITANT Matrix Scientific

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