General Information of the Compound
| Compound ID |
CP0423275
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| Compound Name |
US9193726, 28
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| Structure |
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| Formula |
C24H25ClN4O3
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| Molecular Weight |
452.942
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| Canonical SMILES |
Cc1cn(cn1)-c1ccc2C(=O)N(CCn2c1=O)C1CCCCC1Oc1ccc(Cl)cc1
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| InChI |
InChI=1S/C24H25ClN4O3/c1-16-14-27(15-26-16)20-10-11-21-24(31)28(12-13-29(21)23(20)30)19-4-2-3-5-22(19)32-18-8-6-17(25)7-9-18/h6-11,14-15,19,22H,2-5,12-13H2,1H3
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| InChIKey |
FJHMJYYENFIYQH-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