MetaADEDB 2.0 @ LMMD
1,2-benzisothiazoline-3-one
(DMSMPAJRVJJAGA-UHFFFAOYSA-N)
Structure
SMILES
O=c1[nH]sc2c1cccc2
Molecular Formula:
C7H5NOS
Molecular Weight:
151.186
Log P:
1.5896
Hydrogen Bond Acceptor:
2
Hydrogen Bond Donor:
1
TPSA:
61.1
CAS Number(s):
2634-33-5; 40991-37-5
Synonym(s)
1.
1,2-benzisothiazoline-3-one
2.
1,2-benzisothiazolin-3-one
3.
Proxel
4.
benzisothiazolinone
5.
benzisothiazolone
External Link(s)
MeSHC015699
PubChem Compound17520
BindingDB46658
ChEBI167099
CHEMBLCHEMBL297304
ZINC2581983
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Dermatitis, Allergic Contact26795242CTD
2Poisoning28728110CTD
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