General Information of the Compound
| Compound ID |
CP0886672
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| Compound Name |
(R)-1-(7-Fluoro-2,2-dimethylchroman-4-yl)-3-(1-methyl-1H-indazol-4-yl)urea
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| Structure |
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| Formula |
C20H21FN4O2
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| Molecular Weight |
368.412
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| Canonical SMILES |
Cn1ncc2c(NC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)cccc21
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| InChI |
InChI=1S/C20H21FN4O2/c1-20(2)10-16(13-8-7-12(21)9-18(13)27-20)24-19(26)23-15-5-4-6-17-14(15)11-22-25(17)3/h4-9,11,16H,10H2,1-3H3,(H2,23,24,26)/t16-/m1/s1
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| InChIKey |
KDYCVYMESWOYDY-MRXNPFEDSA-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