General Information of the Compound
| Compound ID |
CP0510553
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| Compound Name |
1-(2-phenoxyphenyl)-3-(3-(5-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)phenyl)urea
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| Structure |
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| Formula |
C32H24N4O2
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| Molecular Weight |
496.57
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| Canonical SMILES |
O=C(Nc1cccc(c1)-c1c[nH]c2ncc(cc12)-c1ccccc1)Nc1ccccc1Oc1ccccc1
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| InChI |
InChI=1S/C32H24N4O2/c37-32(36-29-16-7-8-17-30(29)38-26-14-5-2-6-15-26)35-25-13-9-12-23(18-25)28-21-34-31-27(28)19-24(20-33-31)22-10-3-1-4-11-22/h1-21H,(H,33,34)(H2,35,36,37)
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| InChIKey |
KHXQFTMLDRTUBS-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