Molecular Properties | |
SMILES: | Cc1ccccc1NC(=O)CC1SC(=O)N(c2ccccc2)C1=O |
MW: | 340.09 |
Fraction sp3: | 0.17 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 66.48 |
cLogP: | 3.59 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-6295135337 |
MolPort: | MolPort-000-466-502 |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.443178538136843 |
IC50 (µM) - RapidFire: | 0.658113873254842 |
Order Status | |
Shipped: | 2020-11-17 |
thioester
Thiazolidinone
LON-WEI-4d77710c-75
1.000
LON-WEI-5e7d1b3e-74
0.590
LON-WEI-4d77710c-74
0.590
MAR-TRE-0fda4e82-60
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AAR-UNI-c25c2f1e-42
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WJF-WAB-5e8b96ca-1
0.280
MAR-TRE-f5c2d31c-57
0.280
MAR-TRE-f6f5f473-5
0.271
TRY-UNI-714a760b-5
0.268
MAR-TRE-3e4e6814-32
0.267
MAT-POS-590ac91e-23
0.259
ALE-HEI-f28a35b5-6
0.259
EDG-MED-0da5ad92-4
0.259
TRY-UNI-714a760b-10
0.259
MAT-POS-590ac91e-24
0.256
MAR-TRE-67513f76-34
0.253
TRY-UNI-714a760b-6
0.250
BEN-DND-93268d01-13
0.250
BEN-DND-6de5dfa0-2
0.250
BEN-DND-09b88bf4-1
0.250
MAR-TRE-0fda4e82-85
0.250
DAR-DIA-0cde14eb-78
0.247
WAR-XCH-b6889685-30
0.247
MAK-UNK-6ca90168-26
0.247
MAR-TRE-3e4e6814-74
0.245
BEN-DND-1e24cf73-3
0.245
EDG-MED-0da5ad92-9
0.244
MAR-TRE-7f7bb9f0-36
0.242
MAR-TRE-14ce9fd6-51
0.241
LON-WEI-af038623-7
0.241
MAT-POS-f42f3716-8
0.241
MAR-TRE-7f7bb9f0-72
0.240
MAR-TRE-d0525fbf-96
0.240
ALP-POS-90c18d1d-1
0.240
MAR-TRE-7f7bb9f0-51
0.240
ALP-POS-f13221e1-4
0.239
TRY-UNI-2eddb1ff-2
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EDG-MED-0da5ad92-8
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ASH-SAT-43770c7d-9
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MAR-TRE-9c797165-6
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MAR-TRE-0fda4e82-54
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GAB-REV-70cc3ca5-3
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MAK-UNK-6ca90168-27
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JAN-GHE-83b26c96-12
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AHN-SAT-de2502ba-10
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MAT-POS-590ac91e-7
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RED-SAT-26a928c9-1
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SAM-UNK-2684b532-8
0.232
KEI-TRE-d5e2018a-86
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ANU-UNK-2781581f-1
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MAR-TRE-4b834d9a-74
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ALP-POS-95b75b4d-4
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PET-SGC-2e937068-1
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MAR-TRE-9c797165-54
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AHN-SAT-de2502ba-9
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MAR-TRE-9c797165-53
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KOV-VNK-5e1a909f-21
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MAR-TRE-9c797165-81
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MIH-UNI-6b9ca91a-1
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MAR-TRE-6a44bbf2-44
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MAR-TRE-6a44bbf2-70
0.230
RUB-POS-1325a9ea-5
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ALE-HEI-f28a35b5-12
0.229
MAR-TRE-6a44bbf2-97
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MAR-TRE-6a44bbf2-93
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MAR-TRE-4b834d9a-85
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DOU-UNK-b5326f8f-18
0.229
MAT-POS-590ac91e-25
0.228
EDJ-MED-e58735b6-1
0.228
AHN-SAT-de2502ba-13
0.228
MAR-TRE-6a44bbf2-83
0.228
MAR-TRE-9c797165-72
0.228
PET-SGC-a3e47117-1
0.228
BEN-DND-93268d01-3
0.227
EDJ-MED-c9f55a56-1
0.227
SAM-UNK-2684b532-1
0.227
GAB-REV-70cc3ca5-23
0.227
MAR-TRE-b77b7921-99
0.226
MIC-UNK-df342a3f-2
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BAR-COM-0f94fc3d-1
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ALE-HEI-f28a35b5-1
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TRY-UNI-714a760b-4
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TRY-UNI-2eddb1ff-1
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MAK-UNK-9e4a73aa-4
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ANN-UNI-98d2bf15-2
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MED-UNK-e6e8ef8a-8
0.225
JOH-UNI-abfda500-6
0.225
ANN-UNI-98d2bf15-1
0.225
WIL-WAB-6ef46ddb-1
0.224
MAK-UNK-129dcd6f-16
0.224
WAR-XCH-e55cba98-11
0.224
PET-SGC-d5b502b1-1
0.224
SER-UNI-985a0e14-3
0.224
BEN-DND-93268d01-6
0.223
MAK-UNK-9e4a73aa-6
0.223
MAR-TRE-67513f76-10
0.223
SAD-SAT-7d5528d9-7
0.223
BEN-DND-09b88bf4-7
0.223
TAT-ENA-80bfd3e5-28
0.222
JAN-GHE-83b26c96-13
0.222