General Information of the Compound
| Compound ID |
CP0378894
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| Compound Name |
ethyl 2-[(4R)-4-[[2-benzyl-3-(hydroxyamino)-3-oxopropanoyl]amino]-3-oxo-4,5-dihydro-1H-2-benzazepin-2-yl]acetate
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| Structure |
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| Formula |
C24H27N3O6
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| Molecular Weight |
453.495
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| Canonical SMILES |
CCOC(=O)CN1Cc2ccccc2C[C@@H](NC(=O)C(Cc2ccccc2)C(=O)NO)C1=O
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| InChI |
InChI=1S/C24H27N3O6/c1-2-33-21(28)15-27-14-18-11-7-6-10-17(18)13-20(24(27)31)25-22(29)19(23(30)26-32)12-16-8-4-3-5-9-16/h3-11,19-20,32H,2,12-15H2,1H3,(H,25,29)(H,26,30)/t19?,20-/m1/s1
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| InChIKey |
DVEBEYPHRHJXBU-GFOWMXPYSA-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