Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(Cc2cc(Cl)ccc2CNS(=O)(=O)N2CCOCC2)CC1 |
MW: | 465.403 |
Fraction sp3: | 0.61 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 82.19 |
cLogP: | 0.8896 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Order Status | |
Ordered: | 2020-04-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Hetero_hetero
STU-CHA-128b80be-1
0.808
STU-CHA-128b80be-2
0.779
STU-CHA-6cae54d3-1
0.634
MAK-UNK-10799360-10
0.593
STU-CHA-7b3b91d5-1
0.533
MED-COV-4280ac29-37
0.531
STU-CHA-5350f95a-1
0.495
HYO-UNK-50298ba0-1
0.464
TAM-UNI-d1c3dd9f-4
0.456
DAR-DIA-fb20be43-16
0.438
TAM-UNI-d1c3dd9f-1
0.438
SEA-TRI-67e8f1c7-1
0.422
SEL-UNI-cd366922-6
0.395
PAU-UNI-19862c28-1
0.393
DAR-DIA-fb20be43-8
0.393
MIH-UNI-e573136b-5
0.391
NEH-REV-107bcf72-5
0.390
DAR-DIA-fb20be43-18
0.390
MAK-UNK-7c9d1431-29
0.390
SAD-SAT-5b1897b2-5
0.388
HYO-UNK-49a60884-1
0.383
MED-COV-4280ac29-15
0.383
JOH-UNI-0e1753c1-3
0.383
AAR-POS-d2a4d1df-35
0.383
DRR-IMP-38dce17f-8
0.382
JOO-PER-58e158bd-1
0.380
MAK-UNK-7c9d1431-20
0.378
DAR-DIA-fb20be43-15
0.374
SAD-SAT-65574d3f-10
0.372
BOG-INS-bdba9cfb-1
0.371
MAK-UNK-10799360-12
0.371
SAD-SAT-bc31ec01-1
0.370
TAM-UNI-d1c3dd9f-17
0.370
DAR-DIA-fb20be43-9
0.368
TAM-UNI-d1c3dd9f-12
0.368
DAR-DIA-fb20be43-12
0.368
PAU-UNI-8cdd41c7-1
0.367
DAR-DIA-fb20be43-7
0.366
DAR-DIA-fb20be43-3
0.366
DAR-DIA-fb20be43-17
0.363
MAT-POS-2db6411e-2
0.361
SAD-SAT-581007d4-7
0.361
JIA-UNI-93b03cae-1
0.361
SAD-SAT-581007d4-2
0.361
DRR-IMP-38dce17f-3
0.359
MAK-UNK-7c9d1431-24
0.359
TAM-UNI-d1c3dd9f-6
0.358
TAM-UNI-d1c3dd9f-18
0.355
AAR-POS-0daf6b7e-2
0.354
TAM-UNI-d1c3dd9f-20
0.354
AAR-POS-d2a4d1df-40
0.352
MED-COV-4280ac29-31
0.352
MED-COV-4280ac29-33
0.352
KIM-UNI-7d12df64-1
0.352
SAD-SAT-581007d4-3
0.352
DAR-DIA-fb20be43-2
0.352
DAR-DIA-fb20be43-5
0.351
MAR-LAB-ca4662a6-2
0.349
KIM-UNI-7d12df64-3
0.349
MIH-UNI-e573136b-4
0.347
STU-CHA-bc0a9883-1
0.347
JOK-SYG-302da050-1
0.347
TAM-UNI-d1c3dd9f-19
0.347
NAU-LAT-f723e322-1
0.347
DAR-DIA-fb20be43-11
0.347
MAK-UNK-af83ef51-27
0.346
ALP-POS-d7944b10-12
0.346
SAD-SAT-581007d4-1
0.345
AAR-POS-d2a4d1df-24
0.345
STE-UNK-13e151dd-1
0.344
SEL-UNI-cd366922-7
0.344
BRU-LEF-ae0885ba-1
0.344
PAU-UNI-52c0427f-1
0.344
DAR-DIA-fb20be43-4
0.344
JOK-SYG-302da050-2
0.343
DRR-IMP-38dce17f-1
0.341
MAR-TRE-6a44bbf2-54
0.341
KAT-UNK-b2a0d5b1-1
0.341
MAK-UNK-7c9d1431-16
0.341
MAK-UNK-7c9d1431-14
0.341
NEH-REV-107bcf72-3
0.341
DAR-DIA-fb20be43-1
0.340
MAK-UNK-7c9d1431-28
0.337
AAR-POS-0daf6b7e-17
0.337
LON-WEI-8f408cad-5
0.337
SAD-SAT-581007d4-4
0.337
STU-CHA-464c0256-1
0.337
MAK-UNK-176ca439-2
0.337
DAR-DIA-fb20be43-14
0.337
DUN-NEW-f8ce3686-24
0.333
AAR-POS-0daf6b7e-12
0.333
JOH-UNI-27ac80fd-23
0.333
AHN-SAT-de2502ba-15
0.333
DRR-IMP-38dce17f-6
0.333
DAR-DIA-fb20be43-6
0.333
TAM-UNI-d1c3dd9f-5
0.330
TAM-UNI-d1c3dd9f-13
0.330
DAV-CRI-d1e0885a-2
0.330
JOK-SYG-18591e8f-1
0.330
JOK-SYG-b9f02a42-3
0.327