General Information of the Compound
| Compound ID |
CP0484545
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| Compound Name |
N'-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]-N'-[[(2R)-1,2,3,4-tetrahydroquinolin-2-yl]methyl]butane-1,4-diamine
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| Structure |
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| Formula |
C23H32N4
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| Molecular Weight |
364.537
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| Canonical SMILES |
NCCCCN(C[C@H]1CCc2ccccc2N1)[C@H]1CCCc2cccnc12
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| InChI |
InChI=1S/C23H32N4/c24-14-3-4-16-27(22-11-5-8-19-9-6-15-25-23(19)22)17-20-13-12-18-7-1-2-10-21(18)26-20/h1-2,6-7,9-10,15,20,22,26H,3-5,8,11-14,16-17,24H2/t20-,22+/m1/s1
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| InChIKey |
KRKPKZOTZGHYAF-IRLDBZIGSA-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