General Information of the Compound
| Compound ID |
CP0065927
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| Compound Name |
2'-amino-6-[3-(difluoromethoxy)phenyl]-2,2,3'-trimethylspiro[3H-chromene-4,5'-imidazole]-4'-one
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| Structure |
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| Formula |
C21H21F2N3O3
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| Molecular Weight |
401.413
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| Canonical SMILES |
CN1C(N)=NC2(CC(C)(C)Oc3ccc(cc23)-c2cccc(OC(F)F)c2)C1=O
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| InChI |
InChI=1S/C21H21F2N3O3/c1-20(2)11-21(17(27)26(3)19(24)25-21)15-10-13(7-8-16(15)29-20)12-5-4-6-14(9-12)28-18(22)23/h4-10,18H,11H2,1-3H3,(H2,24,25)
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| InChIKey |
VQNCDPHEWAYVDD-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