Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(C(=O)c2ccoc2)CC1 |
MW: | 256.06 |
Fraction sp3: | 0.45 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 53.76 |
cLogP: | 0.8 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z1562123936 |
AAR-POS-d2a4d1df-27
MAK-UNK-987948f6-2
0.560
DRR-IMP-db50bf6e-3
0.549
AAR-POS-d2a4d1df-25
0.538
MAK-UNK-6ca90168-20
0.538
AHN-SAT-de2502ba-8
0.538
DRR-IMP-db50bf6e-1
0.538
MAR-TRE-6a44bbf2-61
0.509
AAR-POS-d2a4d1df-29
0.509
ASH-SAT-43770c7d-10
0.509
MAK-UNK-987948f6-3
0.509
MAK-UNK-6ca90168-15
0.509
DRR-IMP-db50bf6e-2
0.492
SAD-SAT-3a925b8b-4
0.481
SAD-SAT-1b030f84-9
0.475
SAD-SAT-581007d4-5
0.474
JUL-TUD-06b2044f-136
0.463
SAD-SAT-3a925b8b-2
0.448
JOH-UNI-27ac80fd-25
0.446
AAR-POS-0daf6b7e-16
0.446
SAD-SAT-3a925b8b-1
0.446
SAD-SAT-581007d4-6
0.435
MAK-UNK-704ed37c-11
0.435
SAD-SAT-1b030f84-5
0.421
AAR-POS-0daf6b7e-21
0.413
MAK-UNK-6ca90168-18
0.400
MAK-UNK-7c9d1431-24
0.393
DRR-IMP-38dce17f-3
0.393
MAK-UNK-987948f6-4
0.392
MAK-UNK-6ca90168-1
0.391
MAK-UNK-52a1ef4b-1
0.389
YOI-UNK-090ea88a-1
0.389
MAK-UNK-7c9d1431-29
0.386
MAK-UNK-7c9d1431-28
0.383
BEN-DND-76ad4ac9-8
0.381
MAK-UNK-987948f6-5
0.380
MAK-UNK-6ca90168-16
0.380
DRR-IMP-38dce17f-6
0.379
MAK-UNK-6ca90168-17
0.373
MAK-UNK-704ed37c-12
0.373
MAK-UNK-7c9d1431-13
0.371
MAR-TRE-6a44bbf2-78
0.371
MAK-UNK-6ca90168-10
0.367
MAR-TRE-6a44bbf2-21
0.367
MAK-UNK-7c9d1431-9
0.367
AHN-SAT-de2502ba-7
0.367
AAR-POS-0daf6b7e-13
0.367
MAK-UNK-212f693e-8
0.367
LON-WEI-8f408cad-7
0.367
SAD-SAT-1b030f84-8
0.365
MAK-UNK-704ed37c-10
0.365
SAD-SAT-5b1897b2-9
0.365
MAK-UNK-6ca90168-9
0.365
MAT-POS-ee51dedd-1
0.364
MAT-POS-162a9720-4
0.362
AAR-POS-d2a4d1df-44
0.361
MAK-UNK-6ca90168-14
0.361
DRR-IMP-38dce17f-7
0.361
LON-WEI-8f408cad-5
0.361
AAR-POS-0daf6b7e-17
0.361
DRR-IMP-dff87f5e-3
0.361
AAR-POS-0daf6b7e-2
0.361
MAK-UNK-52a1ef4b-2
0.356
MAK-UNK-52a1ef4b-3
0.356
PAU-UNI-8cdd41c7-1
0.356
SIM-SYN-f15aaa3a-1
0.356
MED-COV-4280ac29-15
0.355
DRR-IMP-dff87f5e-7
0.355
KAY-MCD-d0fe5261-1
0.355
MAR-TRE-6a44bbf2-58
0.355
DRR-IMP-dff87f5e-1
0.355
PEI-IMP-ca0b2813-2
0.355
AAR-POS-d2a4d1df-27
0.355
MAR-LAB-efb042c5-5
0.355
JOH-UNI-0e1753c1-3
0.355
DRR-IMP-38dce17f-4
0.355
MAR-TRE-6a44bbf2-52
0.355
MAR-TRE-6a44bbf2-68
0.355
JOH-UNI-27ac80fd-23
0.355
AAR-POS-d2a4d1df-35
0.355
AAR-POS-d2a4d1df-22
0.355
LON-WEI-8f408cad-3
0.355
HYO-UNK-49a60884-1
0.355
AAR-POS-0daf6b7e-15
0.355
MAR-LAB-ca4662a6-2
0.355
AAR-POS-0daf6b7e-12
0.355
YOI-UNK-15f562e8-4
0.352
VIK-SYN-bf9c9ac8-1
0.352
VIK-SYN-bf9c9ac8-2
0.352
MAK-UNK-704ed37c-13
0.352
SAD-SAT-5b1897b2-10
0.350
NIM-UNI-05f93fcc-1
0.349
MAK-UNK-7c9d1431-23
0.349
JIA-UNI-93b03cae-1
0.349
SAD-SAT-3a925b8b-3
0.349
AAR-POS-d2a4d1df-24
0.349
SWA-SYN-d2e6fa14-1
0.349
SWA-SYN-6423ea73-1
0.349
MAK-UNK-7c9d1431-20
0.349
MAR-TRE-6a44bbf2-28
0.349
MAK-UNK-6ca90168-4
0.349