Molecular Properties | |
SMILES: | CNS(=O)(=O)N1CC(C(=O)Nc2cncc3ccccc23)c2cc(Cl)ccc2C1=O |
MW: | 444.07 |
Fraction sp3: | 0.15 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 108.47 |
cLogP: | 2.53 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-07-06 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Hetero_hetero
EDJ-MED-0047eae5-1
0.805
EDJ-MED-0047eae5-2
0.769
EDJ-MED-827e7cb4-2
0.734
PET-UNK-8f269638-1
0.711
PET-UNK-8f269638-2
0.711
MIC-UNK-91acba05-2
0.708
EDJ-MED-eb111c00-1
0.708
ALP-POS-c56c1477-3
0.707
EDJ-MED-968bafd9-1
0.700
MAT-POS-acfe5bae-4
0.686
TET-ENA-df1c4375-1
0.686
LUO-POS-3f66b338-1
0.684
EDJ-MED-eb111c00-4
0.684
EDJ-MED-12c4873b-4
0.684
EDJ-MED-43f8f7d6-1
0.684
PET-UNK-4d432d33-6
0.670
PET-UNK-4d432d33-2
0.670
MAT-POS-a54ce14d-2
0.667
MAT-POS-acfe5bae-2
0.667
EDJ-MED-015fb6b4-2
0.667
MAT-POS-a54ce14d-3
0.667
PET-UNK-4d432d33-1
0.663
PET-UNK-4d432d33-5
0.663
PET-UNK-f860268d-2
0.660
PET-UNK-f860268d-5
0.660
ALP-POS-b3e0acc5-1
0.657
MIC-UNK-482af05e-4
0.656
EDJ-MED-eb111c00-3
0.653
MIC-UNK-482af05e-3
0.649
LUO-POS-8701f4c8-1
0.640
EDJ-MED-43f8f7d6-2
0.640
EDJ-MED-12c4873b-2
0.640
JOH-UNI-6b98e24c-2
0.640
PET-UNK-c7ac4d9e-2
0.636
EDJ-MED-12c4873b-8
0.636
EDJ-MED-43f8f7d6-8
0.636
RAL-THA-8f106089-1
0.636
RAL-THA-8f106089-2
0.636
RAL-THA-5e0a6f1a-1
0.636
MAT-POS-e2d70d27-1
0.636
PET-UNK-c7ac4d9e-1
0.636
EDJ-MED-eb111c00-2
0.630
DAR-DIA-0f2f46c9-9
0.629
DAR-DIA-0f2f46c9-7
0.629
DAR-DIA-0f2f46c9-8
0.629
ALP-POS-d054b76b-1
0.628
RAL-THA-a9c31980-1
0.624
EDJ-MED-c99b2211-2
0.624
RAL-THA-a9c31980-4
0.624
LUO-POS-868e8996-3
0.624
LUO-POS-868e8996-4
0.624
EDJ-MED-43f8f7d6-7
0.620
EDJ-MED-12c4873b-6
0.620
RAL-THA-8f106089-3
0.620
RAL-THA-8f106089-4
0.620
RAL-THA-a9c31980-3
0.618
EDJ-MED-43f8f7d6-3
0.618
JOH-UNI-6b98e24c-1
0.618
MAT-POS-4223bc15-1
0.612
RAL-THA-a9c31980-5
0.612
EDJ-MED-343bb62d-2
0.606
EDJ-MED-cc48ee33-1
0.606
RAL-THA-a9c31980-2
0.606
EDJ-MED-c99b2211-1
0.606
EDJ-MED-43f8f7d6-4
0.602
PET-UNK-37251634-7
0.600
PET-UNK-37251634-14
0.600
PET-UNK-37251634-15
0.600
PET-UNK-37251634-6
0.600
RAL-THA-a9c31980-6
0.596
RAL-THA-a9c31980-9
0.594
EDJ-MED-cc48ee33-6
0.594
PET-UNK-37251634-8
0.590
PET-UNK-37251634-9
0.590
PET-UNK-37251634-1
0.590
PET-UNK-37251634-16
0.590
PET-UNK-37251634-12
0.585
PET-UNK-37251634-4
0.585
PET-UNK-37251634-10
0.585
RAL-THA-a9c31980-8
0.585
PET-UNK-37251634-11
0.585
PET-UNK-37251634-2
0.585
PET-UNK-37251634-3
0.585
EDJ-MED-43f8f7d6-6
0.585
MAT-POS-24589f88-2
0.582
MAT-POS-24589f88-3
0.582
MAT-POS-dd3ad2b5-4
0.582
PET-UNK-37251634-13
0.579
PET-UNK-37251634-5
0.579
PET-UNK-d62a9a75-1
0.579
PET-UNK-d62a9a75-2
0.579
PET-UNK-d62a9a75-3
0.579
PET-UNK-d62a9a75-4
0.579
ALP-POS-d054b76b-3
0.573
DAR-DIA-0f2f46c9-5
0.571
DAR-DIA-0f2f46c9-6
0.571
DAR-DIA-0f2f46c9-4
0.571
MAT-POS-4223bc15-29
0.567
EDJ-MED-fa7708b3-1
0.567
RAL-THA-ee48ba5f-1
0.567