General Information of the Compound
| Compound ID |
CP0072503
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| Compound Name |
4-phenylthiazole-2-thiol
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| Synonyms |
2(3H)-Thiazolethione, 4-phenyl-
2-Mercapto-4-phenylthiazole
2-Thiazolethiol, 4-phenyl-
2-mercapto-4-phenylthiazol
2103-88-0
4-Phenyl-1,3-thiazole-2-thiol
4-Phenyl-2-mercaptothiazole
4-Phenyl-2-thiazolethiol
4-Phenylthiazole-2(3H)-thione
4-Phenylthiazole-2-thiol
4-Thiazoline-2-thione, 4-phenyl-
4-phenyl-3H-1,3-thiazole-2-thione
4-phenyl-thiazole-2-thiol
4-phenylthiazole-2-thiol
AC1MHDCC
ACMC-1CJ8W
CHEMBL571436
CYCKHTAVNBPQDB-UHFFFAOYSA-N
EINECS 218-274-7
MLS001006837
NSC 678
NSC678
SCHEMBL11460891
SCHEMBL178051
zlchem 830
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| Structure |
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| Formula |
C9H7NS2
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| Molecular Weight |
193.296
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| Canonical SMILES |
Sc1nc(cs1)-c1ccccc1
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| InChI |
InChI=1S/C9H7NS2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-6H,(H,10,11)
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| InChIKey |
CYCKHTAVNBPQDB-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
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000784 | P815B | Mus musculus (Mouse) | 1 |
| 1 |
LD50 > 80000 nM
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TI
LI
LO
TS
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Clinical Information about the Compound