General Information of the Compound
| Compound ID |
CP0176229
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| Compound Name |
2-[(1S,2S)-1,2-di(piperidin-1-yl)-2-pyridin-2-ylethyl]pyridine
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| Structure |
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| Formula |
C22H30N4
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| Molecular Weight |
350.51
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| Canonical SMILES |
C1CCN(CC1)[C@@H]([C@H](N1CCCCC1)c1ccccn1)c1ccccn1
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| InChI |
InChI=1S/C22H30N4/c1-7-15-25(16-8-1)21(19-11-3-5-13-23-19)22(20-12-4-6-14-24-20)26-17-9-2-10-18-26/h3-6,11-14,21-22H,1-2,7-10,15-18H2/t21-,22-/m1/s1
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| InChIKey |
QLTBRUVLRLFPSE-FGZHOGPDSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound