General Information of the Compound
| Compound ID |
CP0387128
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| Compound Name |
propan-2-yl 2-[3-[4-[cyclopropyl(methyl)carbamoyl]-3-fluorophenoxy]propyl]-7-azaspiro[3.5]nonane-7-carboxylate
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| Structure |
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| Formula |
C26H37FN2O4
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| Molecular Weight |
460.59
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| Canonical SMILES |
CC(C)OC(=O)N1CCC2(CC(CCCOc3ccc(C(=O)N(C)C4CC4)c(F)c3)C2)CC1
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| InChI |
InChI=1S/C26H37FN2O4/c1-18(2)33-25(31)29-12-10-26(11-13-29)16-19(17-26)5-4-14-32-21-8-9-22(23(27)15-21)24(30)28(3)20-6-7-20/h8-9,15,18-20H,4-7,10-14,16-17H2,1-3H3
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| InChIKey |
YQDFTBPLJALAGF-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