Ligand
Ligand Name:   3,4-DICHLOROISOCOUMARIN
Ligand Type:   non-polymer
Ligand ID:   COVPDB701 PubChem:   1609
Synonym(s):  
  •   51050-59-0
  • 3,4-dichloro-1h-isochromen-1-one
  • 3,4-dichloroisochromen-1-one
  • 1h-2-benzopyran-1-one,3,4-dichloro-
  • 3,4-dci
  • unii-sd08w1hh6e
  • sd08w1hh6e
  • chembl24983
  • mfcd00036960
  • 3,4-dcl
  • 3,4 dichloroisocoumarin
  • 3,4-dichloro-1h-2-benzopyran-1-one
  • 1h-2-benzopyran-1-one, 3,4-dichloro-
  • 3,4-dichloro-2-benzopyran-1-one
  • 3,4dichloroisocoumarin
  • lopac-d-7910
  • cid_1609
  • lopac0_000442
  • bspbio_001549
  • kbiogr_000269
  • kbioss_000269
  • mls002153325
  • schembl106901
  • 3,4-dichloro-isochromen-1-one
  • kbio2_000269
  • kbio2_002837
  • kbio2_005405
  • kbio3_000537
  • kbio3_000538
  • dtxsid70199056
  • chebi:109540
  • bio2_000269
  • bio2_000749
  • hms1361n11
  • hms1791n11
  • hms1989n11
  • hms3261i06
  • hms3402n11
  • zinc388510
  • tox21_500442
  • bdbm50199883
  • hsci1_000089
  • nsc727363
  • pi-110
  • 3,4-dichloro-1h-isochromen-1-one #
  • ccg-204534
  • db04459
  • lp00442
  • nsc-727363
  • sdccgsbi-0050427.p003
  • idi1_034019
  • qtl1_000002
  • ncgc00015369-01
  • ncgc00015369-02
  • ncgc00015369-03
  • ncgc00015369-04
  • ncgc00015369-05
  • ncgc00015369-06
  • ncgc00015369-08
  • ncgc00093859-01
  • ncgc00093859-02
  • ncgc00093859-03
  • ncgc00261127-01
  • bs-16930
  • smr001230738
  • am20210045
  • eu-0100442
  • d 7910
  • 3,4-dichloroisocoumarin serine protease inhibitor
  • 050d590
  • 3,4-dichloroisocoumarin, serine protease inhibitor
  • sr-01000075831
  • sr-01000075831-1
  • brd-k23704908-001-02-4
  • brd-k23704908-001-03-2
  • q27095241
show 75 synonym(s)
DrugBank:   DB04459 ChEMBL:   CHEMBL24983
Canonical SMILES:   c1cccc(c12)c(=O)oc(Cl)c2Cl
Standard InChI:   InChI=1S/C9H4Cl2O2/c10-7-5-3-1-2-4-6(5)9(12)13-8(7)11/h1-4H
Molecular Formula:   C9H4Cl2O2 Mol. Weight:   213.95883 logP:   3.0998
HBD:   0 HBA:   2
#Rotatable Bonds:   0 TPSA:   30.21

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Complement factor D P00746 (CFAD_HUMAN) Homo sapiens (Human) 1DIC DIC
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