General Information of the Compound
| Compound ID |
CP0868731
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| Compound Name |
(E)-2-(3-ethyl-2-methyl-6,7-dihydro-1H-indol-4(5H)-ylidene)-N-(3-(pyrrolidin-2-yl)phenyl)hydrazinecarboxamide
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| Structure |
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| Formula |
C22H29N5O
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| Molecular Weight |
379.508
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| Canonical SMILES |
CCc1c(C)[nH]c2c1/C(=N/NC(=O)Nc1cccc(C3CCCN3)c1)CCC2
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| InChI |
InChI=1S/C22H29N5O/c1-3-17-14(2)24-19-9-5-10-20(21(17)19)26-27-22(28)25-16-8-4-7-15(13-16)18-11-6-12-23-18/h4,7-8,13,18,23-24H,3,5-6,9-12H2,1-2H3,(H2,25,27,28)/b26-20+
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| InChIKey |
ZMZUJYHRKQZODP-LHLOQNFPSA-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