General Information of the Compound
| Compound ID |
CP0257367
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| Compound Name |
1-(5-oxo-6-pyridin-4-ylpyrido[2,3-b][1,5]benzoxazepin-9-yl)-3-phenylurea
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| Formula |
C24H17N5O3
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| Molecular Weight |
423.432
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| Canonical SMILES |
O=C(Nc1ccccc1)Nc1ccc2N(c3ccncc3)C(=O)c3cccnc3Oc2c1
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| InChI |
InChI=1S/C24H17N5O3/c30-23-19-7-4-12-26-22(19)32-21-15-17(28-24(31)27-16-5-2-1-3-6-16)8-9-20(21)29(23)18-10-13-25-14-11-18/h1-15H,(H2,27,28,31)
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| InChIKey |
FKBZVMKCOKELFC-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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