General Information of the Compound
| Compound ID |
CP0907776
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(Diaminomethylene)-9-hydroxy-5-(methoxymethyl)-9H-fluorene-2-carboxamide hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H18ClN3O3
|
||||||||||||||||||
| Molecular Weight |
347.802
|
||||||||||||||||||
| Canonical SMILES |
COCc1cccc2c1-c1ccc(C(=O)N=C(N)N)cc1C2O.Cl
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H17N3O3.ClH/c1-23-8-10-3-2-4-12-14(10)11-6-5-9(7-13(11)15(12)21)16(22)20-17(18)19;/h2-7,15,21H,8H2,1H3,(H4,18,19,20,22);1H
Show/Hide
|
||||||||||||||||||
| InChIKey |
QEDWJKUEYHSOAK-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00941, 5-hydroxytryptamine receptor 7