UCSF

ZINC22462475

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 16th, 2008 18 Yes

Popular Name: 1-(1-Benzylpyrrolidin-3-yl)piperazine 1-(1-Benzylpyrrolidin-3-yl)piper…

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CAS Numbers: 1032446-30-2 , 765878-69-1

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) 1.19 6.02 -92.17 3 3 2 24 247.386 3 ↓
Hi High (pH 8-9.5) 1.19 4.59 -36.24 2 3 1 20 246.378 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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