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Compound Detail

CHEMBL572964

SULFURIC ACID
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Basic Information

ChEMBL ID CHEMBL572964
Name SULFURIC ACID
Phase Preclinical
Structure Type MOL
InChI Key QAOWNCQODCNURD-UHFFFAOYSA-N

Known Names

Anhydrous sulfuric acid Brimstone acid E-513 E513 INS NO.513 INS-513 NSC-248648 NSC-38965 Sulfuric acid Sulphuricum acidum Tetraoxosulfuric acid
1
Targets
34
Activities
1
Assay Types
0
PK Parameters
20
Publications
11
Known Names

Molecular Properties

98.1
MW (Da)
-0.65
ALogP
2
HBA
2
HBD
74.6
PSA (Ų)
0.39
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product

Extended Properties

Molecular Formula H2O4S
MW 98.08
Aromatic Rings 0
Heavy Atoms 5

Activity Summary

Ki 34 meas. best 6.17

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Carbonic anhydrase V
CHEMBL2111457
 Ki 6.17 6.17 680.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Carbonic anhydrase V Ki = 680.0 nM 6.17 Inhibitory activity against human carbonic anhydrase V expressed in Escherichia ... 15454240

Literature References

PubMed DOI Target Context # Activities
15357993 10.1016/j.bmcl.2004.06.073 Carbonic anhydrase 4
27283786 10.1016/j.bmc.2016.05.029 Unchecked 4
23078755 10.1016/j.bmc.2012.09.047 Unchecked 3
- 10.1039/C5MD00275C Staphylococcus aureus 2
15357993 10.1016/j.bmcl.2004.06.073 Carbonic anhydrase 1 2
15357993 10.1016/j.bmcl.2004.06.073 Carbonic anhydrase 2 2
15357993 10.1016/j.bmcl.2004.06.073 Carbonic anhydrase 4 2
26853167 10.1016/j.bmcl.2016.01.072 Unchecked 2
- 10.1039/C5MD00275C Pseudomonas aeruginosa 2
15454240 10.1016/j.bmcl.2004.07.086 Carbonic anhydrase 2 1
16621537 10.1016/j.bmcl.2006.03.078 Carbonic anhydrase 7 1
15501038 10.1016/j.bmcl.2004.09.063 Carbonic anhydrase 9 1
27283786 10.1016/j.bmc.2016.05.029 Carbonic anhydrase 1 1
15501038 10.1016/j.bmcl.2004.09.063 Carbonic anhydrase 2 1
15501038 10.1016/j.bmcl.2004.09.063 Carbonic anhydrase 1 1
15454240 10.1016/j.bmcl.2004.07.086 Carbonic anhydrase 13 1
15454240 10.1016/j.bmcl.2004.07.086 Carbonic anhydrase V 1
15664814 10.1016/j.bmcl.2004.11.056 Carbonic anhydrase 9 1
15664814 10.1016/j.bmcl.2004.11.056 Carbonic anhydrase 5A, mitochondrial 1
15664814 10.1016/j.bmcl.2004.11.056 Carbonic anhydrase 4 1

Data from ChEMBL 36 via Core Engine