General Information of the Compound
| Compound ID |
CP0476232
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| Compound Name |
N-[(1S,2S)-1-[3-(2-methoxyethylamino)propanoylamino]-2,3-dihydro-1H-inden-2-yl]-1-methylindole-2-carboxamide
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| Structure |
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| Formula |
C25H30N4O3
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| Molecular Weight |
434.54
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| Canonical SMILES |
COCCNCCC(=O)N[C@@H]1[C@H](Cc2ccccc12)NC(=O)c1cc2ccccc2n1C
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| InChI |
InChI=1S/C25H30N4O3/c1-29-21-10-6-4-8-18(21)16-22(29)25(31)27-20-15-17-7-3-5-9-19(17)24(20)28-23(30)11-12-26-13-14-32-2/h3-10,16,20,24,26H,11-15H2,1-2H3,(H,27,31)(H,28,30)/t20-,24-/m0/s1
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| InChIKey |
ZJUYODJGAMVAAC-RDPSFJRHSA-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