UCSF

ZINC38530204

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 17 Yes

Popular Name: 1-N-Boc-4-Azetidin-3-yl-piperazine 1-N-Boc-4-Azetidin-3-yl-piperazine

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CAS Numbers: 178312-58-8 , 219725-67-4

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) 0.90 2.34 -44.56 2 5 1 49 242.343 3 ↓
Hi High (pH 8-9.5) 0.90 0.65 -5.38 1 5 0 45 241.335 3 ↓
Lo Low (pH 4.5-6) 0.90 2.82 -40.27 2 5 1 46 242.343 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% )