General Information of the Compound
| Compound ID |
CP0177530
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| Compound Name |
4-(3,4-dichlorophenyl)-7-(3-(piperidin-1-yl)propoxy)-1,2,3,4-tetrahydro-2,6-naphthyridine
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| Structure |
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| Formula |
C22H27Cl2N3O
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| Molecular Weight |
420.384
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| Canonical SMILES |
Clc1ccc(cc1Cl)C1CNCc2cc(OCCCN3CCCCC3)ncc12
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| InChI |
InChI=1S/C22H27Cl2N3O/c23-20-6-5-16(11-21(20)24)18-14-25-13-17-12-22(26-15-19(17)18)28-10-4-9-27-7-2-1-3-8-27/h5-6,11-12,15,18,25H,1-4,7-10,13-14H2
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| InChIKey |
RTXNVJXREKUAHX-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