Molecular Properties | |
SMILES: | CC(C)(C)CS(=O)(=O)N1Cc2ccc(Cl)cc2C2(CCN(c3cncc4ccccc34)C2=O)C1 |
MW: | 497.15 |
Fraction sp3: | 0.38 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 70.58 |
cLogP: | 4.75 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2022-01-22 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Hetero_hetero
MIK-ENA-5d9157e9-1
ALP-POS-ecbed2ba-13
0.845
EDJ-MED-3707c4bc-1
0.812
ALP-POS-ecbed2ba-3
0.794
PET-UNK-94036022-3
0.776
PET-UNK-94036022-10
0.776
EDJ-MED-accc2c4d-3
0.776
EDJ-MED-7587a9ee-3
0.766
ALP-POS-ecbed2ba-5
0.762
ALP-POS-ecbed2ba-6
0.762
VLA-UNK-61877630-10
0.762
EDJ-MED-5cd3920d-6
0.762
PET-UNK-94036022-9
0.760
EDJ-MED-accc2c4d-1
0.760
PET-UNK-94036022-2
0.760
EDJ-MED-4138fde9-8
0.760
ALP-POS-ecbed2ba-1
0.755
MIK-ENA-5d9157e9-1
0.752
MIK-ENA-5d9157e9-2
0.752
ALP-POS-ecbed2ba-4
0.752
EDJ-MED-8bb691af-6
0.752
EDJ-MED-5cd3920d-5
0.745
LUO-POS-ed2cfb03-2
0.742
EDJ-MED-4138fde9-9
0.738
ALP-POS-ecbed2ba-8
0.738
EDJ-MED-4138fde9-7
0.733
ALP-POS-ecbed2ba-20
0.732
ALP-POS-ecbed2ba-15
0.724
ALP-POS-ecbed2ba-22
0.724
ALP-POS-ecbed2ba-18
0.723
LUO-POS-ed2cfb03-1
0.713
ALP-POS-ecbed2ba-17
0.712
ALP-POS-ecbed2ba-19
0.702
ALP-POS-ecbed2ba-11
0.697
ALP-POS-ecbed2ba-10
0.692
ALP-POS-ecbed2ba-2
0.691
EDJ-MED-accc2c4d-4
0.689
ALP-POS-ecbed2ba-21
0.682
ALP-POS-ecbed2ba-16
0.676
ALP-POS-ecbed2ba-9
0.670
EDJ-MED-accc2c4d-2
0.670
EDJ-MED-40e596c8-1
0.648
LUO-POS-e1dab717-19
0.647
EDJ-MED-7587a9ee-2
0.647
VLA-UNK-3bd6fc51-1
0.641
EDJ-MED-6b23330e-2
0.639
ALP-POS-133e7cd9-2
0.636
LUO-POS-868e8996-11
0.635
MAT-POS-c7726e07-6
0.635
EDJ-MED-8bb691af-4
0.635
MAT-POS-c7726e07-5
0.635
LUO-POS-868e8996-12
0.635
EDJ-MED-6b23330e-1
0.624
EDJ-MED-6b23330e-7
0.624
MAT-POS-69786b79-3
0.620
MAT-POS-853c0ffa-20
0.619
EDJ-MED-6b23330e-4
0.618
MAT-POS-69786b79-1
0.617
MAT-POS-576f7758-1
0.617
MAT-POS-566864e2-3
0.617
MAT-POS-566864e2-4
0.617
LUO-POS-e1dab717-1
0.617
ALP-POS-ecbed2ba-7
0.617
MAT-POS-853c0ffa-21
0.613
EDJ-MED-6b23330e-6
0.613
ALP-POS-c3a90b22-6
0.611
PET-UNK-7e9559de-4
0.609
MAT-POS-96396902-1
0.609
ALP-POS-c3a90b22-7
0.609
PET-UNK-7e9559de-1
0.609
MAT-POS-853c0ffa-22
0.607
EDJ-MED-cc48ee33-3
0.606
EDJ-MED-40e596c8-2
0.604
ALP-POS-ecbed2ba-14
0.600
EDJ-MED-b6c6ee2b-4
0.600
MIK-ENA-4a1c9a78-1
0.600
MAT-POS-69786b79-2
0.600
MIK-ENA-1494235a-1
0.600
MIK-ENA-4ed700b1-1
0.600
BRU-THA-ae0174a8-1
0.600
EDJ-MED-6b23330e-5
0.595
MAT-POS-e75f6e44-4
0.595
EDJ-MED-33064c06-16
0.593
MAT-POS-e75f6e44-10
0.593
EDJ-MED-6b23330e-3
0.591
ALP-POS-c3a90b22-2
0.591
MAT-POS-853c0ffa-12
0.590
MAT-POS-853c0ffa-11
0.590
MAT-POS-e75f6e44-7
0.589
VLA-UNK-61877630-8
0.588
VLA-UNK-e334495f-2
0.588
ALP-POS-ecbed2ba-12
0.586
EDJ-MED-cc48ee33-4
0.586
MAT-POS-566864e2-1
0.586
MAT-POS-e75f6e44-1
0.586
MAT-POS-e75f6e44-5
0.586
MAT-POS-566864e2-2
0.586
MAT-POS-e75f6e44-6
0.584
MAT-POS-e75f6e44-19
0.584
MAT-POS-853c0ffa-14
0.583
MAT-POS-be048f2c-8
0.583