General Information of the Compound
| Compound ID |
CP0405692
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| Compound Name |
2,3-dihydrobenzo[d]thiazole-2-thiol
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| Synonyms |
2(3H)-Benzothiazolethiol
2,3-dihydro-1,3-benzothiazole-2-thiol
2,3-dihydrobenzo[d]thiazole-2-thiol
2,3-dihydrobenzothiazole-2-thiol
2-benzo[d]thiazolinethiol
94495-79-1
AC1MMT8Q
AKOS006278847
BDBM50303907
CHEMBL570797
SCHEMBL1405549
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| Structure |
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| Formula |
C7H7NS2
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| Molecular Weight |
169.274
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| Canonical SMILES |
SC1Nc2ccccc2S1
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| InChI |
InChI=1S/C7H7NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4,7-9H
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| InChIKey |
PYVUUPVBIDIYPY-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01557, Indoleamine 2,3-dioxygenase 1
Protein ID: PT03388, Indoleamine 2,3-dioxygenase 1
Protein ID: PT05447, Tryptophan 2,3-dioxygenase
Clinical Information about the Compound