General Information of the Compound
| Compound ID |
CP0481953
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| Compound Name |
1-(9H-carbazol-4-yloxy)-3-[[1-[(4-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]methyl-methylamino]propan-2-ol
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| Structure |
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| Formula |
C29H31ClN4O2
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| Molecular Weight |
503.046
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| Canonical SMILES |
CN(CC(O)COc1cccc2[nH]c3ccccc3c12)Cc1c(C)nn(Cc2ccc(Cl)cc2)c1C
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| InChI |
InChI=1S/C29H31ClN4O2/c1-19-25(20(2)34(32-19)15-21-11-13-22(30)14-12-21)17-33(3)16-23(35)18-36-28-10-6-9-27-29(28)24-7-4-5-8-26(24)31-27/h4-14,23,31,35H,15-18H2,1-3H3
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| InChIKey |
SQOUCOIXEZFUOA-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