Ligand

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Ligand Name:   2-carbazol-9-yl-N-(2-chloranyl-6-cyano-phenyl)ethanamide
HET ID:   DYR PubChem:   91827381
DrugBank:   - ChEMBL:   -
Canonical SMILES:   N#Cc1cccc(c1NC(=O)Cn1c2ccccc2c2c1cccc2)Cl
Standard InChI:   InChI=1S/C21H14ClN3O/c22-17-9-5-6-14(12-23)21(17)24-20(26)13-25-18-10-3-1-7-15(18)16-8-2-4-11-19(16)25/h1-11H,13H2,(H,24,26)
Molecular Formula:   C21H14ClN3O Mol. Weight:   359.80835 Heavy Atoms:   26
Charge:   0 Is Chiral:   False logP:   5.03128
HBD:   1 HBA:   4 TPSA:   57.82
#Bonds:   29 #Rotatable Bonds:   4 Shape Complexity:   0.05
Stereocomplexity:   0.0
Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID Binding Affinity Binding Database Complex Card
Cryptochrome-1 P97784 (CRY1_MOUSE) Mus musculus 6KX5
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