UCSF

ZINC19737248

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 11 Yes

Popular Name: 1-(3-Methylbutyl)piperazine 1-(3-Methylbutyl)piperazine

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CAS Numbers: , 34581-22-1 , 34581-23-2 , [34581-23-2]

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) 1.29 2.76 -37.97 2 2 1 20 157.281 3 ↓
Lo Low (pH 4.5-6) 1.29 3.67 -31.35 2 2 1 16 157.281 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 291 - 293 Enamine Building Blocks
MP 291...293 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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