General Information of the Compound
| Compound ID |
CP0465300
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| Compound Name |
N-(2-cyclopropylethyl)-6-[4-[5-methyl-2-(trifluoromethyl)furan-3-carbonyl]piperazin-1-yl]pyridazine-3-carboxamide
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| Structure |
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| Formula |
C21H24F3N5O3
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| Molecular Weight |
451.449
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| Canonical SMILES |
Cc1cc(C(=O)N2CCN(CC2)c2ccc(nn2)C(=O)NCCC2CC2)c(o1)C(F)(F)F
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| InChI |
InChI=1S/C21H24F3N5O3/c1-13-12-15(18(32-13)21(22,23)24)20(31)29-10-8-28(9-11-29)17-5-4-16(26-27-17)19(30)25-7-6-14-2-3-14/h4-5,12,14H,2-3,6-11H2,1H3,(H,25,30)
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| InChIKey |
KJMXCRFBUNSWBZ-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