General Information of the Compound
| Compound ID |
CP0416899
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| Compound Name |
N-[(1S,2R)-1-[3-(dimethylamino)propanoylamino]-2,3-dihydro-1H-inden-2-yl]-5-methyl-1H-indole-2-carboxamide
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| Structure |
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| Formula |
C24H28N4O2
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| Molecular Weight |
404.514
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| Canonical SMILES |
CN(C)CCC(=O)N[C@@H]1[C@@H](Cc2ccccc12)NC(=O)c1cc2cc(C)ccc2[nH]1
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| InChI |
InChI=1S/C24H28N4O2/c1-15-8-9-19-17(12-15)14-21(25-19)24(30)26-20-13-16-6-4-5-7-18(16)23(20)27-22(29)10-11-28(2)3/h4-9,12,14,20,23,25H,10-11,13H2,1-3H3,(H,26,30)(H,27,29)/t20-,23+/m1/s1
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| InChIKey |
IVSKBLPKDGJOST-OFNKIYASSA-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