UCSF

ZINC03441670

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2004 17 Yes

Popular Name: 1-(2,3,4,5,6-pentafluorophenyl)piperazine 1-(2,3,4,5,6-pentafluorophenyl)p…

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CAS Numbers: 1052530-86-5 , 872467-63-5 , [1052530-86-5]

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) 1.87 5.33 -43.28 2 2 1 20 253.194 1 ↓
Hi High (pH 8-9.5) 1.87 4 -2.16 1 2 0 15 252.186 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 155 - 157 Enamine Building Blocks
MP 155...157 Enamine Building Blocks
MP 188 - 190 Enamine Building Blocks
MP 188...190 Enamine Building Blocks
MP 192 - 194 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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