Molecular Properties | |
SMILES: | CS(=O)(=O)Nc1cccc(C(=O)NCC(O)c2cccc(F)c2)c1 |
MW: | 352.09 |
Fraction sp3: | 0.19 |
HBA: | 4 |
HBD: | 3 |
Rotatable Bonds: | 6 |
TPSA: | 95.5 |
cLogP: | 1.66 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Hetero_hetero
WIL-UNI-1faa9b10-15
0.476
WIL-UNI-1faa9b10-52
0.407
AAR-POS-0daf6b7e-31
0.394
MAK-UNK-6435e6c2-7
0.394
WIL-UNI-1faa9b10-17
0.386
JAR-IMP-ed466bb3-18
0.367
MAR-TRE-66ac689e-98
0.353
MAR-TRE-66ac689e-73
0.349
MAR-TRE-799db12b-73
0.349
MAK-UNK-9159f8ed-6
0.344
MAK-UNK-1e8f9e3c-1
0.344
MAK-UNK-902cc841-13
0.307
WIL-UNI-1faa9b10-11
0.304
MAK-UNK-902cc841-11
0.303
WIL-UNI-1faa9b10-6
0.300
SUG-SAT-4be79373-4
0.299
WIL-UNI-1faa9b10-2
0.299
MAR-TRE-92684b97-91
0.297
WIL-UNI-1faa9b10-46
0.295
MAR-TRE-66ac689e-68
0.292
MAR-LAB-ca4662a6-4
0.291
MAR-TRE-9d18ae8c-10
0.289
JON-UIO-066ce08b-14
0.286
MAK-UNK-9159f8ed-7
0.283
WIL-UNI-1faa9b10-44
0.283
WIL-UNI-1faa9b10-45
0.275
MAR-TRE-799db12b-39
0.275
AAR-UNI-c25c2f1e-39
0.274
MAK-UNK-9159f8ed-4
0.274
AAR-UNI-c25c2f1e-30
0.273
MAK-UNK-9159f8ed-5
0.272
AAR-UNI-c25c2f1e-94
0.271
MAR-TRE-8190bb11-36
0.270
MAK-UNK-37f1d6fa-6
0.268
MAR-TRE-be9ff7d2-49
0.264
ALP-POS-e980f4ea-9
0.263
IND-SYN-a2b2ab0e-3
0.262
IND-SYN-5e5c1c3e-3
0.262
MAR-TRE-9d18ae8c-1
0.258
ALP-POS-e980f4ea-11
0.256
WIL-UNI-1faa9b10-31
0.255
JAR-KUA-41bd5a3d-7
0.255
MAK-UNK-27459e11-15
0.253
JUA-UNI-b93289a4-7
0.250
PET-UNK-48ab5cd7-1
0.250
MAR-TRE-799db12b-75
0.250
MAR-TRE-92684b97-18
0.250
WIL-UNI-354943b6-8
0.248
BRU-THA-92256091-15
0.248
ALP-POS-305f6ec3-56
0.248
ALP-POS-e980f4ea-27
0.248
MAT-POS-02ae579f-1
0.248
KHR-WEI-75c61062-2
0.248
AAR-UNI-c25c2f1e-37
0.248
AAR-UNI-c25c2f1e-6
0.248
MAR-TRE-9d18ae8c-36
0.247
JON-UIO-066ce08b-7
0.247
ALP-UNI-fe744232-15
0.246
ALP-POS-e980f4ea-5
0.246
NAU-LAT-f723e322-3
0.245
IND-SYN-a2b2ab0e-4
0.244
IND-SYN-5e5c1c3e-4
0.244
AAR-UNI-c25c2f1e-89
0.244
JOE-NOR-4e4adc6b-1
0.243
ALP-POS-02c6a514-52
0.243
ALP-POS-1245c3fa-1
0.243
LON-WEI-2e27a2e5-2
0.243
MAR-TRE-6a44bbf2-71
0.242
MAR-TRE-e82e6c98-14
0.242
WIL-UNI-1faa9b10-23
0.242
BRU-THA-92256091-20
0.242
WIL-UNI-354943b6-3
0.242
ALP-POS-02c6a514-22
0.241
PET-UNK-48ab5cd7-2
0.241
ALP-POS-02c6a514-11
0.241
ALP-POS-e980f4ea-28
0.241
MAK-UNK-10dfa458-25
0.240
ALP-POS-305f6ec3-35
0.240
ALP-POS-95f71980-36
0.240
ALP-UNI-fe744232-9
0.240
TAM-UNI-c140e31a-10
0.240
WIL-UNI-1faa9b10-9
0.240
KEI-TRE-d5e2018a-25
0.240
MAT-POS-f2460aef-5
0.239
ALP-POS-305f6ec3-14
0.239
ALP-UNI-c3ef0aba-3
0.239
ALP-POS-305f6ec3-55
0.239
ALP-POS-02c6a514-38
0.239
ALP-POS-b0bc6a46-23
0.239
MAK-UNK-902cc841-14
0.238
AAR-UNI-c25c2f1e-83
0.238
MAR-TRE-9d18ae8c-49
0.238
ALP-POS-1245c3fa-2
0.237
ALP-POS-e980f4ea-37
0.237
ALP-POS-ced8ea4d-9
0.237
ALP-POS-02c6a514-33
0.237
MAR-TRE-9d18ae8c-4
0.237
MAT-POS-f2460aef-2
0.237
PET-UNK-7d68125a-4
0.237
MAT-POS-f2460aef-1
0.237