General Information of the Compound
| Compound ID |
CP0474152
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| Compound Name |
propan-2-yl 4-[5-(4-carbamoyl-2,5-difluorophenyl)pyrazolo[3,4-c]pyridin-1-yl]piperidine-1-carboxylate
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| Structure |
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| Formula |
C22H23F2N5O3
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| Molecular Weight |
443.454
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| Canonical SMILES |
CC(C)OC(=O)N1CCC(CC1)n1ncc2cc(ncc12)-c1cc(F)c(cc1F)C(N)=O
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| InChI |
InChI=1S/C22H23F2N5O3/c1-12(2)32-22(31)28-5-3-14(4-6-28)29-20-11-26-19(7-13(20)10-27-29)15-8-18(24)16(21(25)30)9-17(15)23/h7-12,14H,3-6H2,1-2H3,(H2,25,30)
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| InChIKey |
VGZRQTLMHGAICV-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