General Information of the Compound
| Compound ID |
CP0423231
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| Compound Name |
N-(2,4-dimethoxyphenyl)-3-[(dimethylamino)methyl]-N-[1-(2-fluorophenyl)-2-[[(2R)-2-hydroxypropyl]amino]-2-oxoethyl]furan-2-carboxamide
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| Structure |
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| Formula |
C27H32FN3O6
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| Molecular Weight |
513.566
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| Canonical SMILES |
COc1ccc(N(C(C(=O)NC[C@@H](C)O)c2ccccc2F)C(=O)c2occc2CN(C)C)c(OC)c1
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| InChI |
InChI=1S/C27H32FN3O6/c1-17(32)15-29-26(33)24(20-8-6-7-9-21(20)28)31(22-11-10-19(35-4)14-23(22)36-5)27(34)25-18(12-13-37-25)16-30(2)3/h6-14,17,24,32H,15-16H2,1-5H3,(H,29,33)/t17-,24?/m1/s1
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| InChIKey |
AZNZYQZNZJASCI-BPNWFJGMSA-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