General Information of the Compound
| Compound ID |
CP0574556
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| Compound Name |
5-N-(3-chlorophenyl)-3-N-methyl-3-N-(oxetan-3-yloxy)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3,5-dicarboxamide
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| Structure |
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| Formula |
C18H20ClN5O4
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| Molecular Weight |
405.842
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| Canonical SMILES |
CN(OC1COC1)C(=O)c1n[nH]c2CCN(Cc12)C(=O)Nc1cccc(Cl)c1
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| InChI |
InChI=1S/C18H20ClN5O4/c1-23(28-13-9-27-10-13)17(25)16-14-8-24(6-5-15(14)21-22-16)18(26)20-12-4-2-3-11(19)7-12/h2-4,7,13H,5-6,8-10H2,1H3,(H,20,26)(H,21,22)
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| InChIKey |
NBAVDZXCZVFGQN-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