Molecular Properties | |
SMILES: | CCN(CC(C)(C)F)C(=O)C1CCN(C(=O)CCl)CC1C |
MW: | 320.17 |
Fraction sp3: | 0.87 |
HBA: | 2 |
HBD: | 0 |
Rotatable Bonds: | 5 |
TPSA: | 40.62 |
cLogP: | 2.31 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
YOI-UNK-12211982-5
1.000
YOI-UNK-15f562e8-5
0.343
SAD-SAT-d8079f6f-4
0.339
DAV-CRI-7ebcceed-1
0.310
SAD-SAT-edc8a235-7
0.308
MAR-TRE-6a44bbf2-66
0.297
MAK-UNK-750cfbcc-4
0.297
MAK-UNK-6c8f5f75-2
0.290
YOI-UNK-12211982-4
0.286
YOI-UNK-a533afbc-4
0.286
VIR-GIT-7b3d3065-3
0.282
AAR-POS-0daf6b7e-19
0.282
MAR-TRE-6a44bbf2-56
0.282
THO-SYG-f9b2970d-6
0.281
THO-SYG-f9b2970d-8
0.281
SAD-SAT-29425be4-21
0.277
SAD-SAT-29425be4-1
0.277
SAD-SAT-65574d3f-6
0.275
JOH-UNI-27ac80fd-35
0.274
MED-COV-4280ac29-38
0.271
DAN-PUR-3907f623-1
0.270
KAT-UNK-c8a6cb16-1
0.270
LON-WEI-120e5cf5-5
0.269
SAD-SAT-1b030f84-9
0.268
YOI-UNK-a533afbc-6
0.267
YOI-UNK-12211982-6
0.267
PAU-WEI-c6d65c11-1
0.267
MAK-UNK-e4a48a85-14
0.267
MAK-UNK-750cfbcc-2
0.265
WAR-XCH-b0339bbe-18
0.265
AAR-POS-0daf6b7e-21
0.262
JOK-SYG-8934678c-1
0.262
MAK-UNK-750cfbcc-1
0.262
MAK-UNK-6c8f5f75-1
0.262
DAV-UNK-07f953a2-2
0.260
MAK-UNK-704ed37c-11
0.258
SAD-SAT-5b1897b2-9
0.258
MAK-UNK-704ed37c-3
0.257
NIR-THE-0d6461ce-7
0.256
SAD-SAT-29425be4-27
0.255
TAT-ENA-80bfd3e5-10
0.253
SAD-SAT-29425be4-2
0.253
MAK-UNK-8fdbca50-37
0.252
VIK-SYN-bf9c9ac8-1
0.250
MAR-TRE-6a44bbf2-39
0.250
DAN-MCD-881986d8-1
0.250
MAK-UNK-704ed37c-16
0.250
SAD-SAT-29425be4-11
0.250
YOI-UNK-15f562e8-4
0.250
MAK-UNK-704ed37c-14
0.250
JOH-UNI-27ac80fd-8
0.250
AAR-POS-d2a4d1df-33
0.250
VIK-SYN-bf9c9ac8-2
0.250
WAR-XCH-72a8c209-5
0.250
SAD-SAT-29425be4-6
0.247
YOI-UNK-a533afbc-2
0.247
YOI-UNK-12211982-2
0.247
MAK-UNK-af83ef51-6
0.247
NIM-UNI-43fe0159-9
0.247
DRR-IMP-11d47bff-1
0.247
MAK-UNK-987948f6-5
0.246
SAD-SAT-d8079f6f-1
0.246
MAK-UNK-95198336-3
0.246
NIR-THE-0d6461ce-1
0.244
MAK-UNK-7c9d1431-22
0.244
YOI-UNK-15f562e8-2
0.244
MAK-UNK-3f402c2b-28
0.244
MAK-UNK-750cfbcc-3
0.243
MAR-TRE-6a44bbf2-79
0.243
MAK-UNK-704ed37c-17
0.243
MAK-UNK-704ed37c-12
0.242
NIR-THE-0d6461ce-6
0.242
IND-SYN-6c8299e8-1
0.241
MAK-UNK-95198336-4
0.241
NIM-UNI-43fe0159-11
0.241
MAK-UNK-c97f7c8f-1
0.241
KAT-UNK-48001bce-1
0.241
KAT-MCD-525c981a-1
0.241
MAK-UNK-704ed37c-5
0.240
SAD-SAT-29425be4-5
0.239
DAN-LON-a5fc619e-7
0.239
MAK-UNK-987948f6-4
0.239
MAK-UNK-f983951f-21
0.238
JOH-UNI-27ac80fd-28
0.238
DRR-IMP-dff87f5e-6
0.237
GIA-UNK-a79af1bc-1
0.237
MAK-UNK-7c9d1431-17
0.237
SAD-SAT-29425be4-22
0.237
MAK-UNK-704ed37c-7
0.237
MAK-UNK-750cfbcc-5
0.236
VIR-GIT-7b3d3065-2
0.236
AAR-POS-0daf6b7e-9
0.236
SAD-SAT-29425be4-20
0.236
NIM-UNI-310206f0-29
0.236
NIM-UNI-43fe0159-10
0.235
MAK-UNK-f983951f-27
0.235
MAK-UNK-c97f7c8f-2
0.235
VIK-SYN-9a3d118a-8
0.235
MAK-UNK-af83ef51-2
0.235
MAK-UNK-e4a48a85-13
0.235