General Information of the Compound
| Compound ID |
CP0485058
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| Compound Name |
N-[1-[[1-(2-morpholin-4-ylethylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide
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| Structure |
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| Formula |
C31H38N4O4S
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| Molecular Weight |
562.736
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| Canonical SMILES |
O=C(NCCN1CCOCC1)C(Cc1ccccc1)NC(=O)C1(CCCCC1)NC(=O)c1cc2ccccc2s1
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| InChI |
InChI=1S/C31H38N4O4S/c36-28(32-15-16-35-17-19-39-20-18-35)25(21-23-9-3-1-4-10-23)33-30(38)31(13-7-2-8-14-31)34-29(37)27-22-24-11-5-6-12-26(24)40-27/h1,3-6,9-12,22,25H,2,7-8,13-21H2,(H,32,36)(H,33,38)(H,34,37)
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| InChIKey |
GYKPMTDZZOZESG-UHFFFAOYSA-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