General Information of the Compound
| Compound ID |
CP0871523
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| Compound Name |
Trans-5-chloro-N-[-4-((5'-fluoro-2'-oxospiro[cyclopropane-1,3'-indoline]-1'-yl)methyl)cyclohexyl]-2-methylnicotinamide
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| Formula |
C24H25ClFN3O2
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| Molecular Weight |
441.934
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| Canonical SMILES |
Cc1ncc(Cl)cc1C(=O)N[C@H]1CC[C@H](CN2C(=O)C3(CC3)c3cc(F)ccc32)CC1
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| InChI |
InChI=1S/C24H25ClFN3O2/c1-14-19(10-16(25)12-27-14)22(30)28-18-5-2-15(3-6-18)13-29-21-7-4-17(26)11-20(21)24(8-9-24)23(29)31/h4,7,10-12,15,18H,2-3,5-6,8-9,13H2,1H3,(H,28,30)/t15-,18-
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| InChIKey |
IMAXYSCPKOIFBE-RZDIXWSQSA-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
Protein ID: PT01588, Corticotropin-releasing factor receptor 1
Protein ID: PT02921, Corticotropin-releasing factor receptor 2