General Information of the Compound
| Compound ID |
CP0567224
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| Compound Name |
1-ethyl-5-[3-[4-(3-ethyl-3-hydroxypentoxy)-3-methylphenyl]pentan-3-yl]-N-methyl-N-prop-2-enylpyrrole-2-carboxamide
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| Structure |
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| Formula |
C30H46N2O3
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| Molecular Weight |
482.709
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| Canonical SMILES |
CCn1c(ccc1C(CC)(CC)c1ccc(OCCC(O)(CC)CC)c(C)c1)C(=O)N(C)CC=C
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| InChI |
InChI=1S/C30H46N2O3/c1-9-20-31(8)28(33)25-16-18-27(32(25)14-6)30(12-4,13-5)24-15-17-26(23(7)22-24)35-21-19-29(34,10-2)11-3/h9,15-18,22,34H,1,10-14,19-21H2,2-8H3
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| InChIKey |
QFLPNDMLGRGFLY-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