General Information of the Compound
| Compound ID |
CP0211541
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| Compound Name |
6-phenyl-7-[4-({4-[5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}methyl)phenyl]pyrido[2,3-d]pyrimidine-2-carboxamide
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| Structure |
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| Formula |
C33H29N9O
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| Molecular Weight |
567.657
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| Canonical SMILES |
NC(=O)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
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| InChI |
InChI=1S/C33H29N9O/c34-29(43)33-36-19-25-18-26(22-6-2-1-3-7-22)28(37-30(25)38-33)23-11-9-21(10-12-23)20-42-16-13-24(14-17-42)31-39-32(41-40-31)27-8-4-5-15-35-27/h1-12,15,18-19,24H,13-14,16-17,20H2,(H2,34,43)(H,39,40,41)
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| InChIKey |
MKCRPVFQAIQPQA-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