General Information of the Compound
| Compound ID |
CP0465306
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| Compound Name |
N-(3-cyclopropylpropyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide
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| Structure |
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| Formula |
C23H26F3N5O2
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| Molecular Weight |
461.488
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| Canonical SMILES |
FC(F)(F)c1ccccc1C(=O)N1CCN(CC1)c1ccc(nn1)C(=O)NCCCC1CC1
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| InChI |
InChI=1S/C23H26F3N5O2/c24-23(25,26)18-6-2-1-5-17(18)22(33)31-14-12-30(13-15-31)20-10-9-19(28-29-20)21(32)27-11-3-4-16-7-8-16/h1-2,5-6,9-10,16H,3-4,7-8,11-15H2,(H,27,32)
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| InChIKey |
ALNBEEWFQUYNMP-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