Molecular Properties | |
SMILES: | Cc1ccccc1CC(=O)N1CCN(C(=O)CCl)CC1 |
MW: | 294.11 |
Fraction sp3: | 0.47 |
HBA: | 2 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 40.62 |
cLogP: | 1.45 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z1562134680 |
AAR-POS-d2a4d1df-24
MAK-UNK-7c9d1431-20
0.611
MAK-UNK-6ca90168-9
0.544
SAD-SAT-b55127ae-7
0.538
TAT-ENA-80bfd3e5-20
0.525
AAR-POS-d2a4d1df-41
0.525
MAK-UNK-6ca90168-4
0.500
AAR-POS-0daf6b7e-21
0.457
SAD-SAT-1b030f84-9
0.452
VIK-SYN-bf9c9ac8-7
0.429
MAR-TRE-6a44bbf2-87
0.429
VIK-SYN-9a3d118a-4
0.429
MAK-UNK-987948f6-2
0.429
AHN-SAT-de2502ba-7
0.424
GIA-UNK-7337c2f3-9
0.418
ASH-SAT-43770c7d-10
0.417
MAK-UNK-704ed37c-11
0.417
AHN-SAT-de2502ba-8
0.414
AAR-POS-d2a4d1df-25
0.414
MAK-UNK-af83ef51-2
0.406
DRR-IMP-38dce17f-3
0.404
MAK-UNK-7c9d1431-24
0.404
AAR-POS-d2a4d1df-24
0.403
SEL-UNI-cd366922-6
0.403
MAK-UNK-7c9d1431-9
0.400
MAR-TRE-6a44bbf2-21
0.400
MAR-TRE-6a44bbf2-27
0.397
STE-UNK-13e151dd-1
0.394
TAT-ENA-80bfd3e5-30
0.394
SAD-SAT-5b1897b2-4
0.393
MAK-UNK-987948f6-5
0.392
MAK-UNK-7c9d1431-8
0.391
MAR-TRE-6a44bbf2-26
0.391
SIM-SYN-f15aaa3a-1
0.390
AAR-POS-d2a4d1df-29
0.390
MAR-TRE-6a44bbf2-61
0.390
VIK-SYN-bf9c9ac8-1
0.389
YOI-UNK-15f562e8-4
0.389
MAR-TRE-6a44bbf2-68
0.387
MAR-LAB-efb042c5-5
0.387
AAR-POS-d2a4d1df-27
0.387
MAK-UNK-704ed37c-12
0.385
AAR-POS-0daf6b7e-16
0.383
SAD-SAT-5b1897b2-10
0.383
VIK-SYN-9a3d118a-1
0.382
SWA-SYN-d2e6fa14-1
0.381
SWA-SYN-6423ea73-1
0.381
MAK-UNK-7c9d1431-12
0.381
MAK-UNK-6ca90168-1
0.379
MAK-UNK-6ca90168-5
0.379
MAK-UNK-987948f6-4
0.377
MAK-UNK-704ed37c-10
0.377
SAD-SAT-5b1897b2-9
0.377
DRR-IMP-dff87f5e-4
0.377
SAD-SAT-65574d3f-9
0.377
DRR-IMP-38dce17f-1
0.377
SAD-SAT-5b1897b2-3
0.377
MIH-UNI-e573136b-5
0.377
MAK-UNK-6ca90168-7
0.377
PEI-IMP-ca0b2813-3
0.377
MAK-UNK-52a1ef4b-1
0.375
JON-UIO-066ce08b-9
0.373
GIA-UNK-7337c2f3-7
0.373
DRR-IMP-db50bf6e-3
0.373
JON-UIO-066ce08b-16
0.371
MAK-UNK-6ca90168-15
0.371
MAK-UNK-987948f6-3
0.371
DRR-IMP-38dce17f-5
0.371
VIK-SYN-9a3d118a-2
0.369
VIK-SYN-bf9c9ac8-6
0.369
AAR-POS-d2a4d1df-28
0.369
MAK-UNK-e4a48a85-26
0.368
MED-COV-4280ac29-31
0.368
AAR-POS-d2a4d1df-40
0.368
DRR-IMP-db50bf6e-1
0.367
SAD-SAT-3a925b8b-5
0.367
MAK-UNK-6ca90168-20
0.367
MAK-UNK-6ca90168-16
0.365
DRR-IMP-dff87f5e-7
0.365
MAR-LAB-ca4662a6-2
0.365
VIK-SYN-bf9c9ac8-2
0.364
DRR-IMP-db50bf6e-2
0.364
MAK-UNK-704ed37c-13
0.364
MAK-UNK-4b073b5c-16
0.362
MED-COV-dea4df70-1
0.361
JOH-UNI-27ac80fd-25
0.361
SAD-SAT-3a925b8b-1
0.361
SAD-SAT-1b030f84-5
0.361
MAR-TRE-6a44bbf2-78
0.359
MAK-UNK-7c9d1431-13
0.359
AAR-POS-d2a4d1df-32
0.359
LON-WEI-8f408cad-2
0.359
MAR-TRE-6a44bbf2-4
0.359
MAR-TRE-6a44bbf2-28
0.359
MAK-UNK-7c9d1431-23
0.359
AHN-SAT-de2502ba-14
0.359
SAD-SAT-65574d3f-1
0.359
MAR-TRE-6a44bbf2-92
0.359
MAK-UNK-6ca90168-17
0.358
MAK-UNK-6ca90168-18
0.358
AAR-POS-0daf6b7e-3
0.358