General Information of the Compound
| Compound ID |
CP0414362
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| Compound Name |
N-(diaminomethylidene)-9-methoxy-9-(methoxymethyl)fluorene-2-carboxamide;hydrochloride
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| Structure |
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| Formula |
C18H20ClN3O3
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| Molecular Weight |
361.829
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| Canonical SMILES |
Cl.COCC1(OC)c2ccccc2-c2ccc(cc12)C(=O)N=C(N)N
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| InChI |
InChI=1S/C18H19N3O3.ClH/c1-23-10-18(24-2)14-6-4-3-5-12(14)13-8-7-11(9-15(13)18)16(22)21-17(19)20;/h3-9H,10H2,1-2H3,(H4,19,20,21,22);1H
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| InChIKey |
DWVUYDWFNYEMJA-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
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00941, 5-hydroxytryptamine receptor 7