Ligand
Ligand Name:   ~{N}-[3-(4-methoxy-7~{H}-pyrrolo[2,3-d]pyrimidin-5-yl)phenyl]prop-2-enamide
Ligand Type:   non-polymer
Ligand ID:   COVPDB880 PubChem:   -
Synonym(s):   -
DrugBank:   - ChEMBL:   -
Canonical SMILES:   n1cnc(OC)c(c12)c(c[nH]2)-c3cccc(c3)NC(=O)C=C
Standard InChI:   InChI=1S/C16H14N4O2/c1-3-13(21)20-11-6-4-5-10(7-11)12-8-17-15-14(12)16(22-2)19-9-18-15/h3-9H,1H2,2H3,(H,20,21)(H,17,18,19)
Molecular Formula:   C16H14N4O2 Mol. Weight:   294.11166 logP:   2.758
HBD:   2 HBA:   4
#Rotatable Bonds:   4 TPSA:   79.9

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Proto-oncogene tyrosine-protein kinase Src P00523 (SRC_CHICK) Gallus gallus (Chicken) 6HVE GUW
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