General Information of the Compound
| Compound ID |
CP0674918
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| Compound Name |
(Z)-3-[(1-Methylpiperidin-4-ylamino)-phenyl-methylene]-2-oxo-2,3-dihydro-1H-indole-6-carboxylic Acid Methyl Ester
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| Formula |
C23H25N3O3
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| Molecular Weight |
391.471
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| Canonical SMILES |
COC(=O)c1ccc2c(c1)NC(=O)/C2=C(\NC1CCN(C)CC1)c1ccccc1
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| InChI |
InChI=1S/C23H25N3O3/c1-26-12-10-17(11-13-26)24-21(15-6-4-3-5-7-15)20-18-9-8-16(23(28)29-2)14-19(18)25-22(20)27/h3-9,14,17,24H,10-13H2,1-2H3,(H,25,27)/b21-20-
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| InChIKey |
NELGLGILOKCALP-MRCUWXFGSA-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