General Information of the Compound
| Compound ID |
CP0486484
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| Compound Name |
1-{1-[2-(3,3-Difluoro-pyrrolidin-1-yl)-ethyl]-1H-indazol-5-yl}-3-(4-phenoxy-phenyl)-urea
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| Structure |
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| Formula |
C26H25F2N5O2
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| Molecular Weight |
477.515
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| Canonical SMILES |
FC1(F)CCN(CCn2ncc3cc(NC(=O)Nc4ccc(Oc5ccccc5)cc4)ccc23)C1
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| InChI |
InChI=1S/C26H25F2N5O2/c27-26(28)12-13-32(18-26)14-15-33-24-11-8-21(16-19(24)17-29-33)31-25(34)30-20-6-9-23(10-7-20)35-22-4-2-1-3-5-22/h1-11,16-17H,12-15,18H2,(H2,30,31,34)
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| InChIKey |
XXDKQAYEZVIZPB-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