General Information of the Compound
| Compound ID |
CP0858654
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| Compound Name |
N-((1R,3r,5S)-8-(2-(1,3-dioxoisoindolin-2-yl)ethyl)-8-azabicyclo[3.2.1]octan-3-yl)-1-isopropyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
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| Formula |
C30H32N4O4
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| Molecular Weight |
512.61
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| Canonical SMILES |
CC(C)n1c(=O)c(C(=O)N[C@H]2C[C@H]3CC[C@@H](C2)N3CCN2C(=O)c3ccccc3C2=O)cc2ccccc21
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| InChI |
InChI=1S/C30H32N4O4/c1-18(2)34-26-10-6-3-7-19(26)15-25(30(34)38)27(35)31-20-16-21-11-12-22(17-20)32(21)13-14-33-28(36)23-8-4-5-9-24(23)29(33)37/h3-10,15,18,20-22H,11-14,16-17H2,1-2H3,(H,31,35)/t20-,21+,22-
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| InChIKey |
CNEURECLCXUMNB-KOUNCHBCSA-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