General Information of the Compound
| Compound ID |
CP0306776
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| Compound Name |
N-(3,4-dichlorophenyl)-4-[(3R)-1-ethylpiperidine-3-carbonyl]piperazine-1-carboxamide
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| Structure |
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| Formula |
C19H26Cl2N4O2
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| Molecular Weight |
413.349
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| Canonical SMILES |
CCN1CCC[C@H](C1)C(=O)N1CCN(CC1)C(=O)Nc1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C19H26Cl2N4O2/c1-2-23-7-3-4-14(13-23)18(26)24-8-10-25(11-9-24)19(27)22-15-5-6-16(20)17(21)12-15/h5-6,12,14H,2-4,7-11,13H2,1H3,(H,22,27)/t14-/m1/s1
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| InChIKey |
USNLEYVXXNQTEL-CQSZACIVSA-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