General Information of the Compound
| Compound ID |
CP0393931
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| Compound Name |
N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-9,10-dihydrophenanthrene-2-carboxamide
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| Structure |
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| Formula |
C27H28N2O2
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| Molecular Weight |
412.533
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| Canonical SMILES |
O=C(Nc1ccc(OCCN2CCCC2)cc1)c1ccc-2c(CCc3ccccc-23)c1
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| InChI |
InChI=1S/C27H28N2O2/c30-27(22-9-14-26-21(19-22)8-7-20-5-1-2-6-25(20)26)28-23-10-12-24(13-11-23)31-18-17-29-15-3-4-16-29/h1-2,5-6,9-14,19H,3-4,7-8,15-18H2,(H,28,30)
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| InChIKey |
CRMROEJVKCZXPS-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