General Information of the Compound
| Compound ID |
CP0570774
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| Compound Name |
5-(6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-yloxy)-N-[5-(oxan-4-yl)-1,2-oxazol-3-yl]indole-1-carboxamide
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| Structure |
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| Formula |
C23H22N6O4
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| Molecular Weight |
446.467
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| Canonical SMILES |
O=C(Nc1cc(on1)C1CCOCC1)n1ccc2cc(Oc3ncnc4CNCc34)ccc12
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| InChI |
InChI=1S/C23H22N6O4/c30-23(27-21-10-20(33-28-21)14-4-7-31-8-5-14)29-6-3-15-9-16(1-2-19(15)29)32-22-17-11-24-12-18(17)25-13-26-22/h1-3,6,9-10,13-14,24H,4-5,7-8,11-12H2,(H,27,28,30)
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| InChIKey |
SVGOQCWTCILNJV-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