Compound Summary
Compound Information
SB 200646 hydrochloride
Compound Name: | SB 200646 hydrochloride |
Compound CID: | 5311422 |
Synonyms: | SB 200646 hydrochloride |
Iupac Name: | 1-(1-methylindol-5-yl)-3-pyridin-3-ylurea;hydrochloride |
InChI: | InChI=1S/C15H14N4O.ClH/c1-19-8-6-11-9-12(4-5-14(11)19)17-15(20)18-13-3-2-7-16-10-13;/h2-10H,1H3,(H2,17,18,20);1H |
InChIKey: | IGRYPUQJEDJLHC-UHFFFAOYSA-N |
Canonical Smiles: | CN1C=CC2=C1C=CC(=C2)NC(=O)NC3=CN=CC=C3.Cl |
Isomeric Smiles: | CN1C=CC2=C1C=CC(=C2)NC(=O)NC3=CN=CC=C3.Cl |
Molecular Weight: | 302.76 |
Molecular Formula: | C15H15ClN4O |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
SB 200646 hydrochloride
Molecular Weight: | 302.76 |
Molecular Formula: | C15H15ClN4O |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 2 |
Rotatable Bond Count: | 2 |
Heavy Atom Count: | 21 |
Complexity: | 349 |
Synonyms
SB 200646 hydrochloride
Experimental Data
SB 200646 hydrochloride
Experimental Data Visualization
SB 200646 hydrochloride
Statistics Data
SB 200646 hydrochloride
Statistics Data Visualization
SB 200646 hydrochloride
