Molecular Properties | |
SMILES: | CS(=O)(=O)Nc1cccc(NC(=O)C(=O)Nc2ccccc2F)c1 |
MW: | 351.07 |
Fraction sp3: | 0.07 |
HBA: | 4 |
HBD: | 3 |
Rotatable Bonds: | 4 |
TPSA: | 104.37 |
cLogP: | 1.77 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
alpha_dicarbonyl
diketo group
α-Diketones
Filter41_12_dicarbonyl
1,2-dicarbonyl not in ring
Hetero_hetero
Oxalyl
AAR-POS-0daf6b7e-31
0.364
MAK-UNK-6435e6c2-7
0.364
MAK-UNK-2c1752f0-5
0.355
MAK-UNK-9159f8ed-6
0.318
MAK-UNK-1e8f9e3c-1
0.318
WIL-UNI-1faa9b10-7
0.299
TAT-ENA-80bfd3e5-45
0.293
MAT-POS-fa06b69f-7
0.293
JOH-UNI-c7afdb96-9
0.289
WIL-UNI-1faa9b10-28
0.286
MAK-UNK-9159f8ed-5
0.284
MAR-TRE-2fd8122f-65
0.284
IND-SYN-5e5c1c3e-3
0.276
IND-SYN-a2b2ab0e-3
0.276
JAR-IMP-ed466bb3-18
0.276
MAR-TRE-66ac689e-73
0.274
MAR-TRE-799db12b-73
0.274
IND-SYN-a2b2ab0e-4
0.273
IND-SYN-5e5c1c3e-4
0.273
MAK-UNK-9159f8ed-4
0.273
MAK-UNK-9159f8ed-7
0.269
WIL-UNI-1faa9b10-23
0.268
NAU-LAT-f723e322-3
0.256
WAR-XCH-79d12f6e-3
0.253
MAR-TRE-1c920f6f-74
0.250
MAK-UNK-902cc841-11
0.250
WIL-UNI-1faa9b10-11
0.247
MAR-TRE-a3327163-46
0.244
WIL-UNI-1faa9b10-52
0.244
MAK-UNK-902cc841-13
0.242
WIL-UNI-1faa9b10-30
0.242
DRE-WAB-9b73098a-1
0.241
AAR-UNI-c25c2f1e-40
0.238
MAT-POS-90fd5f68-12
0.237
MAT-POS-90fd5f68-30
0.237
MAK-UNK-10dfa458-25
0.237
WIL-UNI-1faa9b10-46
0.235
WIL-UNI-1faa9b10-51
0.235
MIH-UNI-e573136b-15
0.234
CAS-DEP-751a2458-3
0.234
TAM-UNI-d1c3dd9f-22
0.233
WIL-UNI-1faa9b10-4
0.233
MAK-UNK-9159f8ed-2
0.232
MAR-TRE-9d18ae8c-62
0.230
KEI-TRE-d5e2018a-70
0.229
WIL-UNI-1faa9b10-35
0.229
AHN-SAT-de2502ba-6
0.229
MAR-TRE-6a44bbf2-43
0.229
SID-ELM-b654bfa2-3
0.229
KEI-TRE-d5e2018a-43
0.228
WIL-MOD-03b86a88-5
0.228
MAK-UNK-7a704a63-12
0.228
WIL-UNI-1faa9b10-21
0.227
MAK-UNK-9159f8ed-1
0.225
MAR-TRE-d0525fbf-47
0.225
CHA-MCP-85291e1d-6
0.225
WAR-XCH-6eb0722e-2
0.224
MAR-TRE-b77b7921-42
0.224
MAR-TRE-6a44bbf2-90
0.224
AHN-SAT-de2502ba-5
0.224
KEI-TRE-d5e2018a-86
0.223
LON-WEI-4d77710c-6
0.222
KEI-TRE-d5e2018a-25
0.222
ANT-LOU-17aa1493-1
0.222
PET-UNK-c6bcc80b-7
0.222
DRR-IMP-dff87f5e-5
0.222
MAR-TRE-6a44bbf2-8
0.222
AAR-POS-d2a4d1df-34
0.222
LON-WEI-5e7d1b3e-6
0.222
MAR-TRE-f5c2d31c-6
0.221
MAR-TRE-6c5ef77a-47
0.221
AHN-SAT-de2502ba-4
0.221
MAR-TRE-6a44bbf2-100
0.221
SID-ELM-2583a2cd-6
0.221
AAR-UNI-c25c2f1e-18
0.220
MAR-TRE-b77b7921-84
0.219
MED-COV-4280ac29-10
0.218
IND-SYN-6c8299e8-9
0.218
UNK-CYC-68f84b31-43
0.218
WIL-UNI-1faa9b10-8
0.217
SID-ELM-b654bfa2-2
0.217
MAK-UNK-27459e11-12
0.216
LON-WEI-b8d98729-4
0.216
JAN-GHE-1d98ec1c-9
0.216
PET-SGC-b0f8bd49-1
0.216
ASH-UNK-40b46b30-3
0.216
JAN-GHE-1d98ec1c-7
0.216
PET-SGC-d0156db4-1
0.216
LON-WEI-120e5cf5-19
0.216
DRE-WAB-ae4a693c-1
0.216
BEN-DND-362d364a-12
0.216
MAK-UNK-7a704a63-1
0.215
WIL-UNI-1faa9b10-17
0.215
MAK-UNK-1e8f9e3c-2
0.214
MAK-UNK-1e8f9e3c-4
0.214
JOK-SYG-a0b0bf84-1
0.214
WAR-XCH-6eb0722e-6
0.214
MAK-UNK-c8c8f7e2-22
0.214
SEA-TRI-6388eba6-1
0.213
WAR-XCH-bdd24732-24
0.213