Molecule Details
| Molecular Properties | |
| SMILES: | CNC(=O)CN1Cc2cc(F)c(Cl)cc2C2(CCN(c3cncc4ccccc34)C2=O)C1 |
| MW: | 452.14 |
| Fraction sp3: | 0.29 |
| HBA: | 4 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 65.54 |
| cLogP: | 3.26 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
![CNC(=O)CN1Cc2ccc(Cl)cc2[C@@]2(CCN(c3cncc4ccccc34)C2=O)C1](/static/images/loading.7a8cbb7079d7.gif)
MAT-POS-c7726e07-5
ALP-POS-afe0272e-1
0.811
LUO-POS-868e8996-11
0.763
MAT-POS-c7726e07-5
0.763
LUO-POS-868e8996-12
0.763
MAT-POS-c7726e07-6
0.763
EDJ-MED-8bb691af-4
0.763
VLA-UNK-5d8210f0-1
0.683
VLA-UNK-5d8210f0-3
0.657
MIK-ENA-1494235a-1
0.654
MIK-ENA-4ed700b1-1
0.654
MIK-ENA-4a1c9a78-1
0.654
MAT-POS-e75f6e44-6
0.651
ALP-POS-133e7cd9-1
0.648
MAT-POS-69786b79-3
0.645
VLA-UNK-61877630-5
0.645
VLA-UNK-8e615992-2
0.645
EDJ-MED-6b23330e-4
0.642
LUO-POS-e1dab717-19
0.641
BRU-THA-ae0174a8-1
0.639
ALP-POS-ecbed2ba-14
0.639
VLA-UNK-f2612802-2
0.639
EDJ-MED-6b23330e-6
0.636
EDJ-MED-6b23330e-5
0.633
MAT-POS-e75f6e44-4
0.633
EDJ-MED-6b23330e-1
0.633
EDJ-MED-6b23330e-2
0.633
EDJ-MED-6b23330e-7
0.633
MAT-POS-e75f6e44-2
0.633
MAT-POS-e75f6e44-3
0.633
MAT-POS-e75f6e44-7
0.627
VLA-UNK-61877630-8
0.625
VLA-UNK-e334495f-2
0.625
MAT-POS-b4d6b7fc-5
0.624
MAT-POS-566864e2-2
0.624
MIK-ENA-4bb8c98f-1
0.624
MAT-POS-566864e2-1
0.624
MAT-POS-e75f6e44-5
0.624
MAT-POS-69786b79-2
0.624
LUO-POS-b4dec3be-1
0.624
MIK-ENA-610c7cf9-1
0.624
LUO-POS-b4dec3be-2
0.624
ALP-POS-ecbed2ba-12
0.624
MAT-POS-e75f6e44-1
0.624
MAT-POS-e75f6e44-15
0.622
MAT-POS-e75f6e44-19
0.622
ALP-POS-c3a90b22-6
0.620
MAT-POS-ddfe83c6-6
0.617
EDJ-MED-33064c06-16
0.616
MAT-POS-e75f6e44-10
0.616
MAT-POS-e75f6e44-17
0.613
EDJ-MED-40e596c8-1
0.611
MAT-POS-e75f6e44-20
0.611
MAT-POS-e75f6e44-18
0.611
MAT-POS-e75f6e44-12
0.607
MAT-POS-69786b79-4
0.607
MAT-POS-e75f6e44-13
0.607
VLA-UNK-61877630-4
0.606
VLA-UNK-8e615992-1
0.606
MAT-POS-e75f6e44-8
0.605
MAT-POS-e75f6e44-16
0.605
MAT-POS-e75f6e44-21
0.605
MAT-POS-e75f6e44-9
0.605
MAT-POS-e75f6e44-11
0.602
MAT-POS-e75f6e44-14
0.602
EDJ-MED-6b23330e-3
0.600
MAT-POS-38eb6498-5
0.598
VLA-UNK-8e615992-3
0.587
ALP-POS-c3a90b22-2
0.586
EDJ-MED-b6c6ee2b-2
0.584
LUO-POS-9931618f-2
0.583
EDJ-MED-8bb691af-8
0.583
PET-UNK-14142a25-10
0.583
PET-UNK-14142a25-1
0.583
MIK-ENA-37e0b697-1
0.583
LUO-POS-9931618f-1
0.583
ALP-POS-afe0272e-2
0.583
MIK-ENA-794411b8-1
0.583
MAT-POS-576f7758-1
0.582
MAT-POS-566864e2-3
0.582
MAT-POS-69786b79-1
0.582
LUO-POS-e1dab717-1
0.582
MAT-POS-566864e2-4
0.582
ALP-POS-ecbed2ba-7
0.582
MAT-POS-b4d6b7fc-7
0.578
VLA-UNK-3bd6fc51-1
0.574
MIK-ENA-9eb8d9fb-1
0.573
ALP-POS-4483ae88-2
0.571
EDJ-MED-b6c6ee2b-1
0.570
MAT-POS-38eb6498-3
0.570
MAT-POS-b4d6b7fc-6
0.558
MAT-POS-1d5ab790-2
0.558
VLA-UNK-f2612802-3
0.557
ALP-POS-c3a90b22-4
0.557
PET-UNK-c6bcc80b-12
0.550
PET-UNK-c6bcc80b-5
0.550
JAG-UCB-f37eaa14-1
0.547
EDJ-MED-40e596c8-3
0.547
LUO-POS-ed2cfb03-2
0.545
LUO-POS-f7b1afe6-3
0.545
PET-UNK-eeb64427-4
0.544