UCSF

ZINC00216076

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 16 Yes

Popular Name: N-[(4-Fluorophenyl)sulfonyl]-beta-alanine N-[(4-Fluorophenyl)sulfonyl]-bet…

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CAS Numbers: , 208121-88-4 , [208121-88-4]

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) 0.69 2.24 -44.6 1 5 -1 86 246.239 5 ↓

Vendor Notes

Note Type Comments Provided By
MP 123 - 127 Enamine Building Blocks
MP 124 - 126 Enamine Building Blocks
MP 124...126 Enamine Building Blocks
MP 146 - 148 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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