General Information of the Compound
| Compound ID |
CP0708046
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| Compound Name |
(S)-N-(3-(piperazin-1yl)propyl)-N-(((S)-5,6,7,8-tetrahydro-1,6-naphthyridin-7-yl)methyl)-5,6,7,8-tetrahydroquinolin-8-amine
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| Structure |
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| Formula |
C25H36N6
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| Molecular Weight |
420.605
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| Canonical SMILES |
c1cnc2c(c1)CN[C@H](CN(CCCN1CCNCC1)[C@H]1CCCc3cccnc31)C2
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| InChI |
InChI=1S/C25H36N6/c1-5-20-6-2-10-28-25(20)24(8-1)31(14-4-13-30-15-11-26-12-16-30)19-22-17-23-21(18-29-22)7-3-9-27-23/h2-3,6-7,9-10,22,24,26,29H,1,4-5,8,11-19H2/t22-,24-/m0/s1
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| InChIKey |
FGNZWWUIEKGEPN-UPVQGACJSA-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