General Information of the Compound
| Compound ID |
CP0511436
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| Compound Name |
N'-[(3,5-dimethylpyridin-2-yl)methyl]-N'-(1-pyridin-2-ylethyl)butane-1,4-diamine
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| Structure |
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| Formula |
C19H28N4
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| Molecular Weight |
312.461
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| Canonical SMILES |
CC(N(CCCCN)Cc1ncc(C)cc1C)c1ccccn1
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| InChI |
InChI=1S/C19H28N4/c1-15-12-16(2)19(22-13-15)14-23(11-7-5-9-20)17(3)18-8-4-6-10-21-18/h4,6,8,10,12-13,17H,5,7,9,11,14,20H2,1-3H3
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| InChIKey |
ZOSBGNJWLUKHGF-UHFFFAOYSA-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