General Information of the Compound
| Compound ID |
CP0562323
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| Compound Name |
4-(2,3-difluorobenzoyl)-N-(pyridin-4-ylmethyl)-1H-pyrrole-2-carboxamide
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| Structure |
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| Formula |
C18H13F2N3O2
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| Molecular Weight |
341.317
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| Canonical SMILES |
Fc1cccc(C(=O)c2c[nH]c(c2)C(=O)NCc2ccncc2)c1F
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| InChI |
InChI=1S/C18H13F2N3O2/c19-14-3-1-2-13(16(14)20)17(24)12-8-15(22-10-12)18(25)23-9-11-4-6-21-7-5-11/h1-8,10,22H,9H2,(H,23,25)
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| InChIKey |
NFOBAXWNXSZSHD-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