Molecular Properties | |
SMILES: | CC(=O)c1ccc(NC(=O)C2CC3CC2CN3C(=O)CCl)cc1 |
MW: | 334.11 |
Fraction sp3: | 0.47 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 66.48 |
cLogP: | 2.3 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Ketone
MED-COV-4280ac29-15
MAK-UNK-5d2caa6f-16
0.742
MAK-UNK-90d0606b-8
0.706
MAK-UNK-5d2caa6f-20
0.698
MAK-UNK-5d2caa6f-17
0.613
MAK-UNK-90d0606b-10
0.603
MAK-UNK-5d2caa6f-1
0.600
MAK-UNK-90d0606b-2
0.592
MAK-UNK-3f402c2b-19
0.557
MAK-UNK-5d2caa6f-21
0.534
MAK-UNK-5d2caa6f-14
0.530
MAK-UNK-3e0761f8-5
0.526
MAK-UNK-90d0606b-9
0.526
MAK-UNK-5d2caa6f-19
0.506
MAK-UNK-5d2caa6f-22
0.488
LON-WEI-120e5cf5-10
0.486
MAK-UNK-5d2caa6f-13
0.470
MAK-UNK-5d2caa6f-15
0.470
MAK-UNK-3e0761f8-3
0.465
MAK-UNK-3e0761f8-8
0.446
MAK-UNK-5d2caa6f-18
0.442
MAK-UNK-3f402c2b-28
0.429
MAK-UNK-ec98eaf6-5
0.421
MAK-UNK-3f402c2b-20
0.403
MAK-UNK-10799360-24
0.385
MAK-UNK-10799360-25
0.382
MAK-UNK-3f402c2b-18
0.377
MAK-UNK-ec98eaf6-32
0.370
MAR-TRE-6a44bbf2-78
0.370
MAK-UNK-7c9d1431-13
0.370
MAK-UNK-ec98eaf6-43
0.367
MAK-UNK-df1a028e-5
0.358
MAK-UNK-ec98eaf6-36
0.344
LON-WEI-120e5cf5-19
0.341
MAK-UNK-ec98eaf6-38
0.329
MAK-UNK-3f402c2b-4
0.329
LON-WEI-120e5cf5-20
0.325
MAK-UNK-ec98eaf6-48
0.322
MAK-UNK-3f402c2b-29
0.318
NIM-UNI-43fe0159-7
0.316
MAK-UNK-3e0761f8-6
0.312
MAK-UNK-3f402c2b-7
0.312
MAK-UNK-90d0606b-1
0.311
DAV-UNK-4a4263a1-1
0.305
MAK-UNK-3e0761f8-7
0.304
MAK-UNK-5d2caa6f-11
0.303
MAK-UNK-ec98eaf6-37
0.301
MAK-UNK-10799360-34
0.301
MAK-UNK-ec98eaf6-35
0.301
MAK-UNK-ec98eaf6-33
0.296
LON-WEI-120e5cf5-15
0.295
MAR-TRE-6a44bbf2-86
0.295
MAK-UNK-3f402c2b-12
0.294
MAK-UNK-90d0606b-6
0.292
MAK-UNK-3f402c2b-27
0.287
MAK-UNK-df1a028e-7
0.286
MAK-UNK-bae89c02-2
0.286
MAK-UNK-10799360-7
0.286
MAK-UNK-ec98eaf6-34
0.284
LON-WEI-120e5cf5-4
0.284
MAK-UNK-3f402c2b-22
0.284
MAK-UNK-10799360-11
0.283
MAK-UNK-5d2caa6f-3
0.282
MAK-UNK-3f402c2b-16
0.280
MAK-UNK-3f402c2b-5
0.280
MAK-UNK-10799360-2
0.280
MAK-UNK-df1a028e-4
0.279
MAK-UNK-7c9d1431-11
0.277
TAT-ENA-80bfd3e5-43
0.277
MAR-TRE-6a44bbf2-65
0.277
LON-WEI-120e5cf5-17
0.276
AAR-POS-5507155c-2
0.276
LON-WEI-120e5cf5-1
0.276
AAR-POS-f650c5f2-4
0.276
DAN-MCD-0c04f563-1
0.276
MAR-TRE-6a44bbf2-12
0.275
MAK-UNK-3f402c2b-25
0.275
MAK-UNK-3f402c2b-3
0.274
MAK-UNK-3f402c2b-6
0.274
LON-WEI-120e5cf5-11
0.274
MAK-UNK-df1a028e-9
0.272
LON-WEI-120e5cf5-3
0.271
MAK-UNK-ec98eaf6-14
0.270
ASH-SAT-43770c7d-7
0.269
MAK-UNK-ec98eaf6-29
0.269
MAK-UNK-10799360-10
0.269
MAK-UNK-ec98eaf6-17
0.269
PEI-IMP-e4a008a2-1
0.268
MAK-UNK-3f402c2b-15
0.268
DAN-MCD-c163c0bb-1
0.268
MAK-UNK-df1a028e-1
0.267
MAK-UNK-90d0606b-3
0.267
THO-SYG-f9b2970d-1
0.266
MAK-UNK-3f402c2b-26
0.265
MAK-UNK-3f402c2b-2
0.264
MAK-UNK-ec98eaf6-3
0.264
MAK-UNK-3e0761f8-4
0.263
MAK-UNK-10799360-9
0.262
DAN-LON-a5fc619e-8
0.262
MAK-UNK-3f402c2b-9
0.262
MAK-UNK-df1a028e-6
0.262