UCSF

ZINC01561662

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 18 Yes

Popular Name: 3-[4-(3-methylphenyl)piperazin-1-yl]propanoic acid 3-[4-(3-methylphenyl)piperazin-1…

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CAS Numbers: 1172802-40-2 , 500294-64-4

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) 1.87 6.6 -49.49 1 4 0 48 248.326 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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