Molecular Properties | |
SMILES: | Cc1ccncc1NS(=O)(=O)Cc1cccc(Cl)c1 |
MW: | 296.779 |
Fraction sp3: | 0.15 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 59.06 |
cLogP: | 2.98532 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine Extended REAL: | s_232682____6893132____10264064 |
Mcule Ultimate: | OFCLDLFRKXDHBA-UHFFFAOYSA-N |
Order Status | |
Ordered: | 2020-05-17 |
Synthesis Location: | enamine |
Shipped: | 2020-06-01 |
Hetero_hetero
ALE-HEI-f28a35b5-9
ALP-POS-76eab5ce-1
0.528
JAN-GHE-83b26c96-21
0.522
EDG-MED-0da5ad92-6
0.507
TRY-UNI-714a760b-6
0.507
IND-SYN-2c708b29-2
0.491
ALP-POS-f13221e1-4
0.479
EDG-MED-0da5ad92-5
0.440
JAN-GHE-83b26c96-4
0.427
TRY-UNI-2eddb1ff-5
0.427
JAN-GHE-83b26c96-5
0.427
TRY-UNI-714a760b-18
0.427
TRY-UNI-2eddb1ff-4
0.427
RAL-THA-6b94ceba-16
0.425
EDG-MED-0da5ad92-3
0.419
JAN-GHE-83b26c96-8
0.412
SAD-SAT-7d5528d9-7
0.412
JAG-UCB-cedd89ab-8
0.411
TRY-UNI-714a760b-12
0.411
DAR-DIA-2964957d-2
0.408
RAL-THA-6b94ceba-14
0.407
SAD-SAT-7d5528d9-4
0.407
MAK-UNK-6ca90168-24
0.405
SAD-SAT-7d5528d9-13
0.405
SAD-SAT-7d5528d9-12
0.405
JAN-GHE-83b26c96-9
0.403
EDG-MED-0da5ad92-19
0.400
MAK-UNK-f203cb68-3
0.398
SAM-UNK-2684b532-1
0.395
MAK-UNK-f203cb68-18
0.395
EDG-MED-0da5ad92-1
0.395
JAN-GHE-83b26c96-15
0.395
EDG-MED-0da5ad92-10
0.395
JAN-GHE-83b26c96-22
0.395
JAN-GHE-83b26c96-10
0.392
WIL-MOD-03b86a88-5
0.390
MAT-POS-1e5f28a7-1
0.388
BAR-COM-0f94fc3d-38
0.388
JAN-GHE-83b26c96-23
0.385
MAK-UNK-6ca90168-26
0.385
VLA-UCB-05e51b3f-2
0.384
EDG-MED-0da5ad92-20
0.384
NAU-LAT-a5c7d7cb-3
0.384
JAG-UCB-a3ef7265-1
0.384
RIT-AID-a492ba81-1
0.380
ALP-POS-95b75b4d-7
0.380
JAN-GHE-83b26c96-20
0.380
EDG-MED-0da5ad92-11
0.380
ALP-POS-95b75b4d-8
0.378
SAM-UNK-2684b532-13
0.378
RAL-THA-6b94ceba-15
0.378
JOH-UNI-abfda500-4
0.377
ALP-POS-95b75b4d-5
0.375
MAT-POS-bb423b95-4
0.375
RAL-THA-6b94ceba-12
0.373
ALP-POS-95b75b4d-6
0.373
EDG-MED-0da5ad92-8
0.373
TRY-UNI-2eddb1ff-2
0.373
MAK-UNK-f203cb68-1
0.371
WIL-MOD-03b86a88-6
0.369
SAM-UNK-2684b532-4
0.368
RUB-POS-1325a9ea-19
0.367
JIN-POS-6dc588a4-3
0.367
MAT-POS-bb423b95-5
0.367
MAT-POS-136e7878-1
0.367
MAK-UNK-f203cb68-4
0.367
RAL-THA-6b94ceba-13
0.366
BAR-COM-0f94fc3d-25
0.366
SAM-UNK-2684b532-2
0.366
ADA-UCB-6c2cb422-9
0.366
DAN-RED-da448e80-9
0.361
MAT-POS-8feb6e35-1
0.360
ANN-UNI-98d2bf15-3
0.359
JOH-UNI-abfda500-5
0.359
NAU-LAT-445f63e5-5
0.359
DAR-DIA-0cde14eb-79
0.358
EDJ-MED-e58735b6-3
0.358
MAK-UNK-f203cb68-19
0.356
MAK-UNK-f203cb68-20
0.355
MAK-UNK-6ca90168-23
0.354
JIN-POS-6dc588a4-6
0.354
NAU-LAT-0543f7f2-7
0.353
SAM-UNK-2684b532-3
0.352
TRY-UNI-9f475305-3
0.352
NAU-LAT-0543f7f2-5
0.352
NAU-LAT-0543f7f2-2
0.352
MAK-UNK-f203cb68-21
0.352
JAN-GHE-83b26c96-13
0.351
ALP-POS-95b75b4d-2
0.351
PET-UNK-8df914d1-3
0.351
EDJ-MED-e58735b6-2
0.351
JIN-POS-6dc588a4-4
0.350
SAM-UNK-2684b532-12
0.350
SAM-UNK-2684b532-11
0.350
DAR-DIA-0cde14eb-2
0.349
PET-UNK-bbe8d7ff-1
0.349
PET-UNK-bbe8d7ff-2
0.349
RUB-POS-1325a9ea-5
0.349
BAR-COM-ebf5acce-3
0.349
NAU-LAT-0543f7f2-6
0.349
JAN-GHE-d851b096-1
0.349