General Information of the Compound
| Compound ID |
CP0485263
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| Compound Name |
N-[(3R)-6-(3-fluorophenyl)-2-oxoazepan-3-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C24H27FN6O3
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| Molecular Weight |
466.517
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| Canonical SMILES |
Fc1cccc(c1)C1CC[C@@H](NC(=O)N2CCC(CC2)n2c3cccnc3[nH]c2=O)C(=O)NC1
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| InChI |
InChI=1S/C24H27FN6O3/c25-17-4-1-3-15(13-17)16-6-7-19(22(32)27-14-16)28-23(33)30-11-8-18(9-12-30)31-20-5-2-10-26-21(20)29-24(31)34/h1-5,10,13,16,18-19H,6-9,11-12,14H2,(H,27,32)(H,28,33)(H,26,29,34)/t16?,19-/m1/s1
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| InChIKey |
FLWCBOSXEQHPKS-LRTDYKAYSA-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