General Information of the Compound
| Compound ID |
CP0895764
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| Compound Name |
(2E)-N-(Diaminomethylene)-3-(9-hydroxy-9H-fluoren-2-yl)acrylamide monohydrochloride
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| Structure |
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| Formula |
C17H16ClN3O2
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| Molecular Weight |
329.787
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| Canonical SMILES |
Cl.NC(N)=NC(=O)/C=C/c1ccc2c(c1)C(O)c1ccccc1-2
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| InChI |
InChI=1S/C17H15N3O2.ClH/c18-17(19)20-15(21)8-6-10-5-7-12-11-3-1-2-4-13(11)16(22)14(12)9-10;/h1-9,16,22H,(H4,18,19,20,21);1H/b8-6+;
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| InChIKey |
GGLMMEQMJXWWBU-WVLIHFOGSA-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: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00941, 5-hydroxytryptamine receptor 7