General Information of the Compound
| Compound ID |
CP0568276
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| Compound Name |
(6-chloro-3,4-dihydro-2H-quinoxalin-1-yl)-(4-pyridin-2-ylpiperazin-1-yl)methanone
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| Formula |
C18H20ClN5O
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| Molecular Weight |
357.845
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| Canonical SMILES |
Clc1ccc2N(CCNc2c1)C(=O)N1CCN(CC1)c1ccccn1
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| InChI |
InChI=1S/C18H20ClN5O/c19-14-4-5-16-15(13-14)20-7-8-24(16)18(25)23-11-9-22(10-12-23)17-3-1-2-6-21-17/h1-6,13,20H,7-12H2
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| InChIKey |
CHQIKNYHGQHEJO-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