General Information of the Compound
| Compound ID |
CP0463770
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| Compound Name |
4-(3-Chloro-pyridin-2-yl)-piperazine-1-carboxylic acid naphthalen-2-ylamide
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| Structure |
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| Formula |
C20H19ClN4O
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| Molecular Weight |
366.852
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| Canonical SMILES |
Clc1cccnc1N1CCN(CC1)C(=O)Nc1ccc2ccccc2c1
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| InChI |
InChI=1S/C20H19ClN4O/c21-18-6-3-9-22-19(18)24-10-12-25(13-11-24)20(26)23-17-8-7-15-4-1-2-5-16(15)14-17/h1-9,14H,10-13H2,(H,23,26)
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| InChIKey |
ZMABZYFTPAMERF-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