General Information of the Compound
| Compound ID |
CP0377031
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| Compound Name |
(E)-3-Ethyl-5-[(6-fluoro-1H-indol-3-yl)methylene]-2-imino-1methylimidazolidin-4-one
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| Formula |
C15H15FN4O
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| Molecular Weight |
286.31
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| Canonical SMILES |
CCN1C(=N)N(C)\C(=C\c2c[nH]c3cc(F)ccc23)C1=O
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| InChI |
InChI=1S/C15H15FN4O/c1-3-20-14(21)13(19(2)15(20)17)6-9-8-18-12-7-10(16)4-5-11(9)12/h4-8,17-18H,3H2,1-2H3/b13-6+,17-15?
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| InChIKey |
CFIKNQMQZHORRL-DZYRLPQXSA-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C