General Information of the Compound
| Compound ID |
CP0390729
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| Compound Name |
CHEMBL2414695
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| Formula |
C17H26N4O2
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| Molecular Weight |
318.421
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| Canonical SMILES |
CC(C)(C)[C@H]1CC[C@@H](CC1)N1CCOc2ncnc(N)c2C1=O
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| InChI |
InChI=1S/C17H26N4O2/c1-17(2,3)11-4-6-12(7-5-11)21-8-9-23-15-13(16(21)22)14(18)19-10-20-15/h10-12H,4-9H2,1-3H3,(H2,18,19,20)/t11-,12-
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| InChIKey |
IYJJMAZMGOHZMR-HAQNSBGRSA-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