Molecular Properties | |
SMILES: | NS(=O)(=O)c1ccc2c(c1)C(=O)C(=O)N2 |
MW: | 226.0 |
Fraction sp3: | 0.0 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 1 |
TPSA: | 106.33 |
cLogP: | -0.53 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine BB: | EN300-129019 |
Enamine SCR: | Z247609642 |
Mcule: | MCULE-3657652034 |
MolPort: | MolPort-004-305-161 |
Order Status | |
Shipped: | 2020-06-01 |
diketo group
Filter41_12_dicarbonyl
Ketone
LOR-NEU-c8f11034-3
0.468
LOR-NEU-c8f11034-8
0.467
LOR-NOR-30067bb9-13
0.386
NAU-LAT-b0463c38-7
0.338
LOR-NEU-c8f11034-4
0.302
NAU-LAT-b0463c38-5
0.293
LOR-NEU-c8f11034-1
0.288
IND-SYN-5e5c1c3e-2
0.268
IND-SYN-a2b2ab0e-1
0.268
LOR-NOR-30067bb9-1
0.267
WAR-XCH-b72a1bbc-3
0.264
AAR-POS-d2a4d1df-15
0.261
WAR-XCH-b72a1bbc-4
0.250
LIZ-THE-57c545eb-1
0.250
LIZ-THE-d3ff4653-2
0.250
LIZ-THE-d3ff4653-1
0.246
WAR-XCH-b72a1bbc-2
0.245
LIZ-THE-6efed59f-3
0.245
MAK-UNK-53da93bf-5
0.241
AAR-POS-d2a4d1df-4
0.238
SIM-DEM-5935bd74-7
0.235
MAK-UNK-0b1cbb06-4
0.234
WAR-XCH-b6889685-23
0.234
HEI-REL-0c990a45-3
0.234
MAR-LAB-ff9967db-29
0.233
MAR-TRE-87acfbcc-44
0.229
WAR-XCH-b6889685-25
0.229
WAR-XCH-b6889685-26
0.229
JON-UIO-d28d79fe-4
0.227
LIZ-THE-6efed59f-1
0.226
MAR-TRE-6a44bbf2-33
0.224
SAD-SAT-5b1897b2-7
0.224
MAT-POS-7dfc56d9-1
0.222
HEI-REL-0c990a45-2
0.221
MAK-UNK-0b1cbb06-3
0.221
IND-SYN-830dcead-1
0.220
LOR-NOR-30067bb9-14
0.220
IND-SYN-a2b2ab0e-2
0.220
IND-SYN-5e5c1c3e-1
0.220
CHR-UNK-e061132b-1
0.220
CHR-UNK-b46452fc-1
0.220
JON-UIO-82a15e73-5
0.219
IND-SYN-8f867502-2
0.219
JON-UIO-82a15e73-2
0.217
ANT-OPE-47f3bb65-4
0.217
JEF-THE-add32b9a-1
0.216
IND-SYN-8f867502-3
0.215
IND-SYN-058869ff-1
0.215
PET-SGC-6a1b02a9-1
0.213
MAT-POS-b5746674-77
0.213
RIT-RIT-fdc869b4-1
0.213
IND-SYN-8f867502-1
0.212
MAR-TRE-fffca54f-97
0.212
LIZ-THE-6efed59f-2
0.211
PET-SGC-481b48b7-2
0.211
MAR-TRE-fffca54f-16
0.211
WAR-XCH-b72a1bbc-1
0.211
PET-SGC-c4a91520-1
0.207
AAR-POS-0daf6b7e-45
0.207
PET-SGC-6062269a-1
0.206
EDJ-MED-8698005e-1
0.205
JON-UIO-d28d79fe-6
0.203
SIM-DEM-5935bd74-2
0.203
JON-UIO-82a15e73-3
0.203
AMI-CSI-2ea5bed6-11
0.203
JON-UIO-82a15e73-10
0.203
JAN-GHE-1d98ec1c-1
0.200
MAK-UNK-0b1cbb06-5
0.200
EDJ-MED-f073a5ff-2
0.200
CHR-SOS-7098f804-15
0.200
PET-SGC-85e821e4-1
0.200
WAR-XCH-b6889685-29
0.200
WAR-XCH-b6889685-54
0.200
JON-UIO-82a15e73-11
0.200
AMI-CSI-2ea5bed6-9
0.200
WIL-UNI-1faa9b10-33
0.197
WAR-XCH-b6889685-47
0.197
DUN-NEW-f8ce3686-14
0.197
SIM-DEM-5935bd74-4
0.197
WAR-XCH-b72a1bbc-11
0.197
LOR-NOR-f9b26152-1
0.197
MAR-TRE-6a44bbf2-73
0.197
SAD-SAT-65574d3f-2
0.197
ELE-IMP-dfb36048-6
0.197
PED-UNI-89deb5c9-1
0.195
JON-UIO-d28d79fe-5
0.195
PET-SGC-abcbce68-1
0.195
DAV-CRI-14a23e73-1
0.195
WAR-XCH-b6889685-48
0.195
EDJ-MED-f073a5ff-1
0.195
WIL-UNI-1faa9b10-27
0.194
WAR-XCH-b72a1bbc-10
0.194
WAR-XCH-b72a1bbc-14
0.194
WAR-XCH-b72a1bbc-9
0.194
EDJ-MED-f073a5ff-4
0.193
WIL-UNI-1faa9b10-49
0.193
EDJ-MED-e58735b6-3
0.192
WIL-UNI-1faa9b10-16
0.192
JAN-GHE-1d98ec1c-5
0.192
WAR-XCH-b6889685-2
0.192