General Information of the Compound
| Compound ID |
CP0399303
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| Compound Name |
(2-Methyl-3-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrazolo[1,5-a]pyrimidin-8-yl)-pyridin-2-ylmethyl-amine
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| Structure |
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| Formula |
C22H21N5
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| Molecular Weight |
355.445
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| Canonical SMILES |
Cc1nn2c(NCc3ccccn3)c3CCCc3nc2c1-c1ccccc1
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| InChI |
InChI=1S/C22H21N5/c1-15-20(16-8-3-2-4-9-16)22-25-19-12-7-11-18(19)21(27(22)26-15)24-14-17-10-5-6-13-23-17/h2-6,8-10,13,24H,7,11-12,14H2,1H3
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| InChIKey |
UFGNAHYYMKJYSC-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: PT06109, Geminin
Protein ID: PT01214, Tyrosine-protein kinase JAK2