Molecular Properties | |
SMILES: | CC(C)NC(=O)N1CCN(C(=O)CCl)CC1 |
MW: | 247.726 |
Fraction sp3: | 0.8 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 52.65 |
cLogP: | 0.4874 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z1562137780 |
Enamine Extended REAL: | m_270062____7613770____8147258 |
MAK-UNK-704ed37c-12
0.600
SAD-SAT-1b030f84-9
0.559
VIK-SYN-bf9c9ac8-2
0.558
AAR-POS-0daf6b7e-21
0.513
YOI-UNK-15f562e8-4
0.489
VIK-SYN-bf9c9ac8-1
0.489
MAK-UNK-987948f6-5
0.465
MAK-UNK-704ed37c-11
0.463
MAK-UNK-6ca90168-17
0.455
MAK-UNK-987948f6-4
0.444
MAK-UNK-704ed37c-10
0.444
SWA-SYN-d2e6fa14-1
0.436
SWA-SYN-6423ea73-1
0.436
MAK-UNK-4b073b5c-16
0.436
AHN-SAT-de2502ba-7
0.434
MAK-UNK-95198336-3
0.432
MAK-UNK-6ca90168-16
0.432
MAK-UNK-704ed37c-13
0.426
MAK-UNK-6ca90168-18
0.422
SAD-SAT-d8079f6f-3
0.415
SAD-SAT-d8079f6f-5
0.415
SAD-SAT-1b030f84-8
0.413
SAD-SAT-5b1897b2-9
0.413
SAD-SAT-d8079f6f-6
0.405
SAD-SAT-d8079f6f-4
0.386
SAD-SAT-89668ff1-8
0.386
SWA-SYN-d2e6fa14-7
0.383
SWA-SYN-6423ea73-7
0.383
MAK-UNK-6ca90168-10
0.382
MAK-UNK-52a1ef4b-1
0.380
DRR-IMP-11d47bff-1
0.377
MAR-TRE-6a44bbf2-56
0.377
TOB-UNK-c2aba166-1
0.375
MAR-TRE-6a44bbf2-77
0.373
AHN-SAT-de2502ba-8
0.370
SWA-SYN-d2e6fa14-5
0.370
SWA-SYN-6423ea73-5
0.370
SIM-SYN-f15aaa3a-1
0.370
AAR-POS-d2a4d1df-25
0.370
SAD-SAT-edc8a235-3
0.367
MAK-UNK-af83ef51-2
0.367
MAK-UNK-f983951f-21
0.364
SAD-SAT-bc31ec01-2
0.364
SAD-SAT-3a925b8b-1
0.364
JOH-UNI-27ac80fd-25
0.364
AAR-POS-0daf6b7e-16
0.364
MED-COV-4280ac29-6
0.362
MAK-UNK-750cfbcc-2
0.360
WAR-XCH-b0339bbe-18
0.360
MAK-UNK-987948f6-2
0.358
AAR-POS-0daf6b7e-18
0.357
SAD-SAT-65574d3f-9
0.357
KAT-UNK-c8a6cb16-1
0.357
DRR-IMP-db50bf6e-3
0.352
VIR-GIT-7b3d3065-3
0.352
AAR-POS-0daf6b7e-19
0.352
MAT-POS-162a9720-4
0.352
ASH-SAT-43770c7d-10
0.351
SAD-SAT-1b030f84-4
0.351
SAD-SAT-5b1897b2-4
0.351
VIK-SYN-bf9c9ac8-6
0.350
VIK-SYN-9a3d118a-2
0.350
MAR-TRE-6a44bbf2-61
0.345
AAR-POS-d2a4d1df-29
0.345
PAU-UNI-8cdd41c7-1
0.345
MAK-UNK-6ca90168-20
0.345
MAK-UNK-52a1ef4b-2
0.345
DRR-IMP-db50bf6e-1
0.345
MAK-UNK-52a1ef4b-3
0.345
SAD-SAT-3a925b8b-4
0.345
SAD-SAT-3a925b8b-5
0.345
DRR-IMP-38dce17f-6
0.345
NIM-UNI-310206f0-6
0.345
SEL-UNI-cd366922-2
0.344
GIA-UNK-4de5abb1-5
0.343
SAD-SAT-1b030f84-5
0.339
MAK-UNK-7c9d1431-20
0.339
MAK-UNK-6ca90168-4
0.339
MAR-TRE-6a44bbf2-92
0.339
MAR-TRE-6a44bbf2-41
0.339
MAK-UNK-6ca90168-7
0.338
GIA-UNK-7337c2f3-8
0.338
GIA-UNK-4de5abb1-3
0.338
MAR-TRE-6a44bbf2-27
0.338
MIH-UNI-e573136b-7
0.338
GIA-UNK-20b63697-7
0.333
MAR-TRE-6a44bbf2-87
0.333
MAK-UNK-7c9d1431-24
0.333
MAK-UNK-750cfbcc-1
0.333
MAK-UNK-6c8f5f75-1
0.333
KAT-UNK-48001bce-1
0.333
KAT-MCD-525c981a-1
0.333
VIK-SYN-bf9c9ac8-7
0.333
GIA-UNK-7337c2f3-7
0.333
VIK-SYN-9a3d118a-4
0.333
MED-COV-4280ac29-23
0.333
DRR-IMP-38dce17f-3
0.333
MED-COV-4280ac29-7
0.328
GIA-UNK-4de5abb1-1
0.328
GIA-UNK-20b63697-6
0.328