Molecular Properties | |
SMILES: | NC(=O)C1CCN(C(=O)CCl)CS1 |
MW: | 222.02 |
Fraction sp3: | 0.71 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 63.4 |
cLogP: | 0.0 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MAK-UNK-750cfbcc-1
0.444
MAK-UNK-704ed37c-16
0.417
MAK-UNK-704ed37c-14
0.417
MAK-UNK-6c8f5f75-1
0.413
MAK-UNK-4b073b5c-17
0.409
SAD-SAT-edc8a235-7
0.388
WAR-XCH-b0339bbe-18
0.380
SAD-SAT-6b5a89f0-5
0.380
SAD-SAT-d8079f6f-4
0.378
MAK-UNK-95198336-6
0.375
SAD-SAT-65574d3f-6
0.365
MAK-UNK-704ed37c-11
0.356
MAK-UNK-95198336-3
0.350
SAD-SAT-1b030f84-9
0.350
MAK-UNK-95198336-4
0.341
SAD-SAT-d8079f6f-5
0.341
MAK-UNK-704ed37c-4
0.333
MAK-UNK-750cfbcc-5
0.333
SAD-SAT-d8079f6f-6
0.333
MAK-UNK-750cfbcc-2
0.327
SAD-SAT-bc31ec01-2
0.326
MAK-UNK-4b073b5c-16
0.326
MAR-TRE-6a44bbf2-79
0.321
MAK-UNK-750cfbcc-3
0.321
MAK-UNK-704ed37c-15
0.321
SAD-SAT-5b1897b2-9
0.320
MAK-UNK-704ed37c-9
0.317
MAK-UNK-95198336-9
0.312
MAK-UNK-95198336-11
0.311
SAD-SAT-d8079f6f-3
0.311
MAK-UNK-704ed37c-5
0.310
MAK-UNK-95198336-7
0.310
VIR-GIT-7b3d3065-2
0.309
MAK-UNK-6c8f5f75-2
0.309
AAR-POS-0daf6b7e-9
0.309
AAR-POS-0daf6b7e-21
0.304
MAK-UNK-6ca90168-17
0.300
MAK-UNK-6ca90168-18
0.300
MAK-UNK-704ed37c-6
0.300
AAR-POS-0daf6b7e-19
0.298
VIR-GIT-7b3d3065-3
0.298
SAD-SAT-5b1897b2-6
0.298
MAK-UNK-f983951f-21
0.298
MAK-UNK-95198336-8
0.295
MAK-UNK-704ed37c-8
0.295
DAN-LON-a5fc619e-1
0.294
SAD-SAT-1b030f84-8
0.294
MAK-UNK-704ed37c-1
0.293
SAD-SAT-6b5a89f0-2
0.292
YOI-UNK-15f562e8-2
0.290
NIM-UNI-43fe0159-1
0.290
MAK-UNK-212f693e-32
0.290
YOI-UNK-12211982-2
0.290
YOI-UNK-a533afbc-2
0.290
MAK-UNK-704ed37c-3
0.288
MAK-UNK-212f693e-13
0.286
MAK-UNK-212f693e-10
0.286
MAK-UNK-6ca90168-22
0.284
DAN-PUR-3907f623-1
0.283
MAK-UNK-704ed37c-2
0.283
MAK-UNK-704ed37c-7
0.283
YOI-UNK-15f562e8-5
0.283
MAK-UNK-704ed37c-13
0.283
SAD-SAT-edc8a235-3
0.283
VIK-SYN-bf9c9ac8-2
0.283
LON-WEI-120e5cf5-5
0.281
NIM-UNI-43fe0159-2
0.281
MAK-UNK-987948f6-15
0.281
MAK-UNK-987948f6-5
0.280
MAK-UNK-6ca90168-16
0.280
SAD-SAT-edc8a235-10
0.280
MAK-UNK-6ca90168-11
0.279
DRR-IMP-38dce17f-7
0.279
MAK-UNK-6ca90168-14
0.279
SAD-SAT-6b5a89f0-3
0.278
SAD-SAT-6b5a89f0-4
0.278
DRR-IMP-11d47bff-1
0.276
VIK-SYN-9a3d118a-8
0.275
MAK-UNK-704ed37c-12
0.275
MAK-UNK-750cfbcc-4
0.274
ALE-SYG-bac15da4-1
0.274
MAR-TRE-6a44bbf2-66
0.274
NIM-UNI-43fe0159-3
0.274
MAK-UNK-212f693e-11
0.273
MAK-UNK-95198336-5
0.273
MAK-UNK-52a1ef4b-2
0.271
AAR-POS-0daf6b7e-5
0.270
GIA-UNK-c4371e97-2
0.270
NIM-UNI-43fe0159-5
0.270
MAK-UNK-704ed37c-10
0.269
MAK-UNK-987948f6-4
0.269
LON-WEI-120e5cf5-15
0.266
MAR-TRE-6a44bbf2-86
0.266
NIM-UNI-43fe0159-4
0.266
ASH-SAT-43770c7d-5
0.266
MAR-TRE-6a44bbf2-9
0.265
MAK-UNK-f983951f-27
0.264
TOB-UNK-c2aba166-1
0.264
DUN-NEW-f8ce3686-3
0.264
KAT-UNK-c8a6cb16-1
0.262