Molecule Details
| Molecular Properties | |
| SMILES: | CNC(=O)CN1Cc2c(F)cc(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
VLA-UNK-5d8210f0-3
0.821
LUO-POS-868e8996-11
0.717
LUO-POS-868e8996-12
0.717
MAT-POS-c7726e07-6
0.717
EDJ-MED-8bb691af-4
0.717
MAT-POS-c7726e07-5
0.717
VLA-UNK-8e615992-1
0.689
VLA-UNK-61877630-4
0.689
VLA-UNK-5d8210f0-2
0.683
ALP-POS-afe0272e-1
0.660
VLA-UNK-f2612802-3
0.633
MIK-ENA-1494235a-1
0.630
MIK-ENA-4ed700b1-1
0.630
MIK-ENA-4a1c9a78-1
0.630
ALP-POS-133e7cd9-1
0.623
LUO-POS-e1dab717-19
0.615
EDJ-MED-6b23330e-7
0.609
VLA-UNK-8e615992-3
0.607
VLA-UNK-61877630-7
0.607
VLA-UNK-e334495f-1
0.607
MAT-POS-69786b79-3
0.606
LUO-POS-9931618f-2
0.604
EDJ-MED-8bb691af-8
0.604
PET-UNK-14142a25-10
0.604
PET-UNK-14142a25-1
0.604
MIK-ENA-37e0b697-1
0.604
LUO-POS-9931618f-1
0.604
MIK-ENA-794411b8-1
0.604
BRU-THA-ae0174a8-1
0.600
ALP-POS-ecbed2ba-14
0.600
EDJ-MED-6b23330e-6
0.598
MAT-POS-e75f6e44-6
0.598
MAT-POS-e75f6e44-15
0.598
MAT-POS-e75f6e44-19
0.598
ALP-POS-c3a90b22-6
0.596
EDJ-MED-6b23330e-1
0.595
EDJ-MED-6b23330e-2
0.595
EDJ-MED-6b23330e-5
0.595
MAT-POS-e75f6e44-4
0.595
MAT-POS-e75f6e44-2
0.595
ALP-POS-4483ae88-2
0.591
MAT-POS-e75f6e44-7
0.589
MAT-POS-e75f6e44-17
0.589
EDJ-MED-6b23330e-4
0.589
MAT-POS-566864e2-2
0.586
MAT-POS-69786b79-2
0.586
MIK-ENA-4bb8c98f-1
0.586
LUO-POS-b4dec3be-1
0.586
MIK-ENA-610c7cf9-1
0.586
LUO-POS-b4dec3be-2
0.586
MAT-POS-566864e2-1
0.586
MAT-POS-e75f6e44-1
0.586
MAT-POS-e75f6e44-5
0.586
ALP-POS-ecbed2ba-12
0.586
MAT-POS-b4d6b7fc-5
0.586
MAT-POS-e75f6e44-21
0.583
MAT-POS-e75f6e44-3
0.580
EDJ-MED-33064c06-16
0.579
MAT-POS-e75f6e44-10
0.579
MAT-POS-ddfe83c6-6
0.578
VLA-UNK-61877630-5
0.577
ALP-POS-c3a90b22-2
0.577
VLA-UNK-8e615992-2
0.577
MAT-POS-38eb6498-5
0.575
MAT-POS-e75f6e44-18
0.574
MAT-POS-566864e2-4
0.573
MAT-POS-69786b79-1
0.573
LUO-POS-e1dab717-1
0.573
MAT-POS-576f7758-1
0.573
MAT-POS-566864e2-3
0.573
EDJ-MED-40e596c8-1
0.573
ALP-POS-ecbed2ba-7
0.573
VLA-UNK-f2612802-2
0.571
MAT-POS-69786b79-4
0.570
MAT-POS-e75f6e44-12
0.570
MAT-POS-e75f6e44-13
0.570
MAT-POS-e75f6e44-8
0.569
MAT-POS-e75f6e44-9
0.569
MAT-POS-e75f6e44-16
0.569
MAT-POS-e75f6e44-11
0.565
MAT-POS-e75f6e44-14
0.565
EDJ-MED-6b23330e-3
0.564
ALP-POS-c3a90b22-5
0.562
MAT-POS-e75f6e44-20
0.560
ALP-POS-afe0272e-2
0.560
MIK-ENA-9eb8d9fb-1
0.551
VLA-UNK-3bd6fc51-1
0.550
JOH-MSK-4bb3d434-1
0.550
EDJ-MED-b6c6ee2b-2
0.548
ALP-POS-c3a90b22-4
0.548
ALP-POS-c3a90b22-1
0.548
EDJ-MED-98c0a822-3
0.548
LUO-POS-e1dab717-2
0.544
EDJ-MED-976a33d5-1
0.544
MAT-POS-e48723dc-1
0.544
MAT-POS-e48723dc-2
0.544
MAT-POS-576f7758-2
0.544
MAT-POS-b4d6b7fc-7
0.542
PET-UNK-14142a25-11
0.540
PET-UNK-14142a25-2
0.540