General Information of the Compound
| Compound ID |
CP0415200
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| Compound Name |
9-butyl-N-(diaminomethylidene)-9-hydroxyfluorene-2-carboxamide;hydrochloride
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| Structure |
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| Formula |
C19H22ClN3O2
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| Molecular Weight |
359.857
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| Canonical SMILES |
Cl.CCCCC1(O)c2ccccc2-c2ccc(cc12)C(=O)N=C(N)N
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| InChI |
InChI=1S/C19H21N3O2.ClH/c1-2-3-10-19(24)15-7-5-4-6-13(15)14-9-8-12(11-16(14)19)17(23)22-18(20)21;/h4-9,11,24H,2-3,10H2,1H3,(H4,20,21,22,23);1H
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| InChIKey |
PHGKVAMEVAQJAZ-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