General Information of the Compound
| Compound ID |
CP0881866
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| Compound Name |
2-Amino-4-[4-(dimethylamino)phenyl]-7-hydroxy-4H-chromene-3-carbonitrile
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| Structure |
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| Formula |
C18H17N3O2
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| Molecular Weight |
307.353
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| Canonical SMILES |
CN(C)c1ccc(C2C(C#N)=C(N)Oc3cc(O)ccc32)cc1
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| InChI |
InChI=1S/C18H17N3O2/c1-21(2)12-5-3-11(4-6-12)17-14-8-7-13(22)9-16(14)23-18(20)15(17)10-19/h3-9,17,22H,20H2,1-2H3
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| InChIKey |
JXZIXFRUSHDGMU-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