Molecule Details
| Molecular Properties | |
| SMILES: | O=C1N(c2cncc3ccccc23)CCC12CN(CS(=O)(=O)NCC1CC1)Cc1ccc(Cl)cc12 |
| MW: | 510.15 |
| Fraction sp3: | 0.38 |
| HBA: | 5 |
| HBD: | 1 |
| Rotatable Bonds: | 6 |
| TPSA: | 82.61 |
| cLogP: | 3.67 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Order Status | |
| Ordered: | 2022-01-22 |
| Synthesis Location: | enamine |
| Shipped: | synthesis in progress |
Hetero_hetero
![CNC(=O)CN1Cc2ccc(Cl)cc2[C@@]2(CCN(c3cncc4ccccc34)C2=O)C1](/static/images/loading.7a8cbb7079d7.gif)
MAT-POS-c7726e07-5
EDJ-MED-40e596c8-1
0.806
ALP-POS-ecbed2ba-12
0.714
MAT-POS-566864e2-1
0.714
MAT-POS-566864e2-2
0.714
ALP-POS-c3a90b22-7
0.708
MAT-POS-e75f6e44-13
0.694
EDJ-MED-40e596c8-5
0.692
LUO-POS-e1dab717-19
0.686
EDJ-MED-8bb691af-4
0.673
LUO-POS-868e8996-11
0.673
MAT-POS-c7726e07-5
0.673
MAT-POS-c7726e07-6
0.673
LUO-POS-868e8996-12
0.673
EDJ-MED-40e596c8-3
0.673
MIK-ENA-9eb8d9fb-1
0.670
MAT-POS-69786b79-2
0.667
VLA-UNK-3bd6fc51-1
0.663
MAT-POS-e75f6e44-16
0.661
MAT-POS-e75f6e44-14
0.658
MAT-POS-e75f6e44-18
0.652
MAT-POS-e75f6e44-20
0.652
ALP-POS-c3a90b22-6
0.648
MAT-POS-e75f6e44-21
0.646
MAT-POS-69786b79-3
0.642
MIK-ENA-1494235a-1
0.636
MIK-ENA-4ed700b1-1
0.636
BRU-THA-ae0174a8-1
0.636
ALP-POS-ecbed2ba-14
0.636
MIK-ENA-4a1c9a78-1
0.636
MAT-POS-e75f6e44-1
0.636
MAT-POS-e75f6e44-5
0.636
EDJ-MED-7587a9ee-3
0.635
EDJ-MED-6b23330e-6
0.634
ALP-POS-ecbed2ba-18
0.633
LUO-POS-ed2cfb03-2
0.632
MAT-POS-e75f6e44-8
0.632
MAT-POS-e75f6e44-9
0.632
EDJ-MED-6b23330e-1
0.631
EDJ-MED-6b23330e-7
0.631
EDJ-MED-6b23330e-2
0.631
MAT-POS-e75f6e44-4
0.631
EDJ-MED-6b23330e-5
0.631
MAT-POS-e75f6e44-2
0.631
MAT-POS-e75f6e44-3
0.631
EDJ-MED-33064c06-16
0.628
MAT-POS-e75f6e44-10
0.628
MAT-POS-e75f6e44-7
0.625
MAT-POS-e75f6e44-17
0.625
EDJ-MED-6b23330e-4
0.625
EDJ-MED-59d5ca70-2
0.623
ALP-POS-ecbed2ba-20
0.623
EDJ-MED-4138fde9-8
0.622
ALP-POS-ecbed2ba-10
0.622
EDJ-MED-accc2c4d-1
0.622
MAT-POS-69786b79-4
0.619
MAT-POS-e75f6e44-6
0.619
MAT-POS-e75f6e44-15
0.619
MAT-POS-e75f6e44-19
0.619
MAT-POS-e75f6e44-12
0.619
EDJ-MED-accc2c4d-3
0.618
PET-UNK-7e9559de-1
0.616
PET-UNK-7e9559de-4
0.616
MAT-POS-96396902-1
0.616
MAT-POS-e75f6e44-11
0.614
ALP-POS-ecbed2ba-5
0.611
EDJ-MED-4138fde9-9
0.605
EDJ-MED-accc2c4d-4
0.604
ALP-POS-ecbed2ba-3
0.604
PET-UNK-94036022-3
0.604
PET-UNK-94036022-10
0.604
EDJ-MED-3707c4bc-1
0.604
EDJ-MED-3707c4bc-2
0.604
ALP-POS-ecbed2ba-19
0.602
EDJ-MED-accc2c4d-2
0.602
ALP-POS-ecbed2ba-21
0.600
EDJ-MED-6b23330e-3
0.598
ALP-POS-ecbed2ba-6
0.596
ALP-POS-ecbed2ba-17
0.596
ALP-POS-ecbed2ba-16
0.595
LUO-POS-ed2cfb03-1
0.595
PET-UNK-94036022-9
0.593
PET-UNK-94036022-2
0.593
MIK-ENA-5d9157e9-1
0.588
EDJ-MED-8bb691af-6
0.588
ALP-POS-ecbed2ba-9
0.588
MIK-ENA-5d9157e9-2
0.588
ALP-POS-ecbed2ba-4
0.588
ALP-POS-c3a90b22-2
0.584
VLA-UNK-61877630-10
0.583
EDJ-MED-5cd3920d-5
0.583
EDJ-MED-5cd3920d-6
0.583
ALP-POS-ecbed2ba-7
0.580
MAT-POS-69786b79-1
0.580
MAT-POS-576f7758-1
0.580
LUO-POS-e1dab717-1
0.580
MAT-POS-566864e2-3
0.580
MAT-POS-566864e2-4
0.580
ALP-POS-ecbed2ba-8
0.578
ALP-POS-ecbed2ba-13
0.578
ALP-POS-ecbed2ba-1
0.578