Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(C(c2cccc(Cl)c2)c2cccc(Cl)c2)CC1 |
MW: | 397.733 |
Fraction sp3: | 0.32 |
HBA: | 2 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 23.55 |
cLogP: | 4.4658 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-04-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
AAR-POS-d2a4d1df-1
GIA-UNK-7337c2f3-2
0.830
DAR-DIA-3e9bbd81-12
0.830
MED-COV-4280ac29-7
0.818
MED-COV-4280ac29-18
0.815
SEA-TRI-8222e606-1
0.689
PAU-WEI-3e86dfd8-2
0.677
SEA-TRI-2c7f3de8-1
0.667
SIM-SYN-f15aaa3a-1
0.604
GIA-UNK-4de5abb1-4
0.603
GIA-UNK-4de5abb1-1
0.600
GIA-UNK-4de5abb1-2
0.567
GIA-UNK-7337c2f3-1
0.567
GIA-UNK-7337c2f3-8
0.556
GIA-UNK-7337c2f3-5
0.556
MED-COV-4280ac29-23
0.547
MED-COV-4280ac29-34
0.545
GIA-UNK-7337c2f3-11
0.530
DAR-DIA-3e9bbd81-11
0.522
GIA-UNK-7337c2f3-13
0.522
PAU-WEI-b9b69149-1
0.522
MED-COV-4280ac29-15
0.508
AAR-POS-d2a4d1df-35
0.508
HYO-UNK-49a60884-1
0.508
JOH-UNI-0e1753c1-3
0.508
GIA-UNK-7337c2f3-4
0.508
GIA-UNK-7337c2f3-7
0.508
GIA-UNK-7337c2f3-12
0.508
GIA-UNK-4de5abb1-5
0.507
SAD-SAT-65574d3f-9
0.500
GIA-UNK-7337c2f3-10
0.500
PAU-WEI-b9b69149-3
0.500
SIM-SYN-f15aaa3a-2
0.500
DAR-DIA-3e9bbd81-15
0.493
GIA-UNK-7337c2f3-15
0.493
GIA-UNK-20b63697-7
0.492
MAK-UNK-6ca90168-15
0.492
WAL-WAB-df110a02-2
0.486
PAU-WEI-b9b69149-2
0.480
GIA-UNK-c4371e97-3
0.478
GIA-UNK-7337c2f3-3
0.477
GIA-UNK-20b63697-1
0.469
NEH-REV-107bcf72-2
0.466
MAK-UNK-10799360-36
0.456
GIA-UNK-7337c2f3-6
0.455
DRR-IMP-dff87f5e-8
0.453
MED-COV-4280ac29-12
0.446
MED-COV-4280ac29-29
0.446
GIA-UNK-7337c2f3-9
0.441
MAR-TRE-6a44bbf2-92
0.429
MED-COV-4280ac29-11
0.426
SEL-UNI-cd366922-5
0.418
MIH-UNI-e573136b-7
0.417
DAR-DIA-3e9bbd81-3
0.413
MAK-UNK-ec98eaf6-6
0.413
GIA-UNK-7337c2f3-14
0.413
MAK-UNK-af83ef51-2
0.409
GIA-UNK-20b63697-8
0.408
GIA-UNK-4de5abb1-3
0.400
MAK-UNK-7c9d1431-29
0.400
AHN-SAT-de2502ba-1
0.400
MAK-UNK-ec98eaf6-1
0.397
PAU-UNI-8cdd41c7-1
0.393
AAR-POS-0daf6b7e-10
0.393
SEL-UNI-cd366922-9
0.392
SAD-SAT-1b030f84-9
0.391
GIA-UNK-20b63697-6
0.391
MAK-UNK-704ed37c-12
0.389
SEL-UNI-cd366922-2
0.386
MAK-UNK-7c9d1431-23
0.385
AAR-POS-d2a4d1df-24
0.385
MAR-TRE-6a44bbf2-28
0.385
DRR-IMP-38dce17f-3
0.383
MAK-UNK-7c9d1431-24
0.383
PAU-WEI-3e86dfd8-1
0.383
DRR-IMP-dff87f5e-4
0.381
DRR-IMP-38dce17f-1
0.381
AHN-SAT-de2502ba-7
0.381
DAN-LON-a5fc619e-2
0.380
DAN-LON-a5fc619e-1
0.380
DRR-IMP-38dce17f-2
0.379
NIM-UNI-ed9fc491-3
0.378
DRR-IMP-db50bf6e-3
0.377
MAK-UNK-10dfa458-39
0.377
GIA-UNK-20b63697-3
0.375
GIA-UNK-20b63697-2
0.375
GIA-UNK-20b63697-4
0.375
GIA-UNK-20b63697-5
0.375
SAD-SAT-5b1897b2-4
0.375
MAR-TRE-6a44bbf2-77
0.373
DAN-LON-a5fc619e-7
0.372
MAR-TRE-6a44bbf2-61
0.371
DAV-CRI-3edb475e-4
0.371
AAR-POS-d2a4d1df-29
0.371
PAU-WEI-b9b69149-4
0.370
DRR-IMP-38dce17f-4
0.369
SAD-SAT-c989feaa-5
0.368
MAK-UNK-7c9d1431-10
0.368
SAD-SAT-b55127ae-1
0.368
SAD-SAT-29425be4-7
0.367
MAK-UNK-704ed37c-11
0.365