General Information of the Compound
| Compound ID |
CP0569525
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| Compound Name |
US8772323, 137
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| Structure |
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| Formula |
C24H24N4O4
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| Molecular Weight |
432.48
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| Canonical SMILES |
O=C1NN=C(C2CC12)c1ccc2nc(oc2c1)-c1ccc(OCCN2CCOCC2)cc1
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| InChI |
InChI=1S/C24H24N4O4/c29-23-19-14-18(19)22(26-27-23)16-3-6-20-21(13-16)32-24(25-20)15-1-4-17(5-2-15)31-12-9-28-7-10-30-11-8-28/h1-6,13,18-19H,7-12,14H2,(H,27,29)
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| InChIKey |
QVCTYOCVGJUVJQ-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