UCSF

ZINC00882287

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 12 Yes

Popular Name: 1,2,3,4,5,6-Hexahydro-[4,4']bipyridinyl 1,2,3,4,5,6-Hexahydro-[4,4']bipy…

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CAS Number: 581-45-3

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) 0.93 4.18 -44.89 2 2 1 29 163.244 1 ↓
Lo Low (pH 4.5-6) 0.93 4.46 -86.75 3 2 2 31 164.252 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 86-88° Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.