General Information of the Compound
| Compound ID |
CP0497216
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| Compound Name |
N-[2-[1-(4-chlorophenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-8-yl]ethyl]-4-fluorobenzamide
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| Structure |
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| Formula |
C22H24ClFN4O2
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| Molecular Weight |
430.911
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)NCCN1CCC2(CC1)N(CNC2=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C22H24ClFN4O2/c23-17-3-7-19(8-4-17)28-15-26-21(30)22(28)9-12-27(13-10-22)14-11-25-20(29)16-1-5-18(24)6-2-16/h1-8H,9-15H2,(H,25,29)(H,26,30)
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| InChIKey |
FZSPMCRCOODROZ-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
Protein ID: PT01943, Phospholipase D1
Protein ID: PT01153, Phospholipase D2