General Information of the Compound
| Compound ID |
CP0006295
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| Compound Name |
2-amino-N-[(1S)-1-[8-(dimethylamino)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
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| Structure |
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| Formula |
C26H25N7O2
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| Molecular Weight |
467.533
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| Canonical SMILES |
C[C@H](NC(=O)c1c(N)nn2cccnc12)c1cc2cccc(N(C)C)c2c(=O)n1-c1ccccc1
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| InChI |
InChI=1S/C26H25N7O2/c1-16(29-25(34)22-23(27)30-32-14-8-13-28-24(22)32)20-15-17-9-7-12-19(31(2)3)21(17)26(35)33(20)18-10-5-4-6-11-18/h4-16H,1-3H3,(H2,27,30)(H,29,34)/t16-/m0/s1
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| InChIKey |
CVPCCGARLXQEMF-INIZCTEOSA-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