General Information of the Compound
| Compound ID |
CP0560902
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| Compound Name |
US9315518, 11-5
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| Structure |
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| Formula |
C23H29N5O3
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| Molecular Weight |
423.517
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| Canonical SMILES |
Cn1c2nc(ccc2n(CC(C)(C)C)c1=O)C1CC2CN(CC2C1)C(=O)c1ncco1
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| InChI |
InChI=1S/C23H29N5O3/c1-23(2,3)13-28-18-6-5-17(25-19(18)26(4)22(28)30)14-9-15-11-27(12-16(15)10-14)21(29)20-24-7-8-31-20/h5-8,14-16H,9-13H2,1-4H3
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| InChIKey |
GNDJVVLCLJKRST-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