General Information of the Compound
| Compound ID |
CP0567250
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| Compound Name |
N-[3-[[6-[(4-fluorophenyl)methyl]-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]amino]propyl]acetamide
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| Structure |
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| Formula |
C24H27FN6O
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| Molecular Weight |
434.519
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| Canonical SMILES |
CC(=O)NCCCNc1nc(nc2CCN(Cc3ccc(F)cc3)Cc12)-c1ccccn1
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| InChI |
InChI=1S/C24H27FN6O/c1-17(32)26-12-4-13-28-23-20-16-31(15-18-6-8-19(25)9-7-18)14-10-21(20)29-24(30-23)22-5-2-3-11-27-22/h2-3,5-9,11H,4,10,12-16H2,1H3,(H,26,32)(H,28,29,30)
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| InChIKey |
SCSBXLIGNPSNOL-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