General Information of the Compound
| Compound ID |
CP0346927
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| Compound Name |
3-(5-{[(3Z)-5-(carbamoylamino)-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrol-3-yl)benzamide
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| Structure |
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| Formula |
C21H17N5O3
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| Molecular Weight |
387.399
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| Canonical SMILES |
NC(=O)Nc1ccc2NC(=O)\C(=C/c3cc(c[nH]3)-c3cccc(c3)C(N)=O)c2c1
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| InChI |
InChI=1S/C21H17N5O3/c22-19(27)12-3-1-2-11(6-12)13-7-15(24-10-13)9-17-16-8-14(25-21(23)29)4-5-18(16)26-20(17)28/h1-10,24H,(H2,22,27)(H,26,28)(H3,23,25,29)/b17-9-
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| InChIKey |
NXUWGUQHCIIYBD-MFOYZWKCSA-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