General Information of the Compound
| Compound ID |
CP0317452
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| Compound Name |
N-[5-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)pyridin-3-yl]-2-(4-cyanophenyl)acetamide
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| Formula |
C24H21N7O2
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| Molecular Weight |
439.479
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| Canonical SMILES |
CC(C)n1cc(C(=O)c2cncc(NC(=O)Cc3ccc(cc3)C#N)c2)c2c(N)ncnc12
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| InChI |
InChI=1S/C24H21N7O2/c1-14(2)31-12-19(21-23(26)28-13-29-24(21)31)22(33)17-8-18(11-27-10-17)30-20(32)7-15-3-5-16(9-25)6-4-15/h3-6,8,10-14H,7H2,1-2H3,(H,30,32)(H2,26,28,29)
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| InChIKey |
AJAJWYFGMGQXPX-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
Protein ID: PT01390, BDNF/NT-3 growth factors receptor
Protein ID: PT00934, High affinity nerve growth factor receptor