General Information of the Compound
| Compound ID |
CP0553170
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| Compound Name |
6-[(3S)-3-aminopyrrolidin-1-yl]-N-(2-morpholin-4-yl-5-piperidin-1-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl)pyridine-2-carboxamide
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| Structure |
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| Formula |
C25H32N8O3
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| Molecular Weight |
492.584
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| Canonical SMILES |
N[C@H]1CCN(C1)c1cccc(n1)C(=O)Nc1cc2oc(nc2nc1N1CCCCC1)N1CCOCC1
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| InChI |
InChI=1S/C25H32N8O3/c26-17-7-10-33(16-17)21-6-4-5-18(27-21)24(34)28-19-15-20-22(29-23(19)31-8-2-1-3-9-31)30-25(36-20)32-11-13-35-14-12-32/h4-6,15,17H,1-3,7-14,16,26H2,(H,28,34)/t17-/m0/s1
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| InChIKey |
RBFAZQNXZNXJNI-KRWDZBQOSA-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