Molecular Properties | |
SMILES: | CS(=O)(=O)N1Cc2ccc(Cl)cc2[C@](F)(C(=O)Nc2cncc3cc(F)ccc23)C1 |
MW: | 451.06 |
Fraction sp3: | 0.2 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 79.37 |
cLogP: | 3.61 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Hetero_hetero
PET-UNK-6da3dcd8-14
0.811
PET-UNK-6da3dcd8-2
0.750
PET-UNK-6da3dcd8-17
0.727
PET-UNK-6da3dcd8-20
0.720
PET-UNK-6da3dcd8-11
0.698
PET-UNK-03fd2068-9
0.698
PET-UNK-bcc8fd08-6
0.670
PET-UNK-6da3dcd8-4
0.606
PET-UNK-407a74a5-17
0.598
PET-UNK-6da3dcd8-13
0.596
PET-UNK-407a74a5-9
0.596
PET-UNK-b566c0b0-9
0.590
PET-UNK-03fd2068-11
0.571
PET-UNK-407a74a5-16
0.550
PET-UNK-407a74a5-18
0.550
PET-UNK-03fd2068-4
0.549
PET-UNK-6da3dcd8-15
0.549
JOH-UNI-06d7cc04-1
0.546
PET-UNK-6da3dcd8-7
0.546
PET-UNK-6da3dcd8-18
0.544
PET-UNK-6da3dcd8-10
0.541
PET-UNK-6da3dcd8-16
0.540
PET-UNK-6da3dcd8-19
0.535
PET-UNK-407a74a5-15
0.535
PET-UNK-c65ea24c-1
0.533
JOH-UNI-06346b80-1
0.527
EDJ-MED-841e0cf0-3
0.524
EDJ-MED-670ad2ee-3
0.524
EDJ-MED-923a35c2-5
0.524
JOH-UNI-e398da21-2
0.519
MIC-UNK-6e9f8a43-1
0.519
PET-UNK-f4e47ebd-27
0.514
EDG-MED-b8f93667-3
0.505
ALP-POS-5290f14d-1
0.505
PET-UNK-6da3dcd8-1
0.505
PET-UNK-9bf1291a-1
0.505
MIC-UNK-ea4eb352-2
0.505
PET-UNK-bcc8fd08-5
0.505
PET-UNK-f4e47ebd-24
0.500
PET-UNK-b566c0b0-1
0.500
PET-UNK-bcc8fd08-4
0.495
PET-UNK-03fd2068-6
0.495
PET-UNK-b38839dc-22
0.491
PET-UNK-6e612674-5
0.491
PET-UNK-6e612674-13
0.491
PET-UNK-b78139fa-14
0.490
PET-UNK-407a74a5-14
0.486
PET-UNK-6e612674-1
0.486
PET-UNK-6e612674-9
0.486
PET-UNK-f9b7ae87-5
0.486
PET-UNK-407a74a5-12
0.486
PET-UNK-407a74a5-13
0.481
MAT-POS-c88128cb-13
0.481
PET-UNK-ad758083-1
0.477
PET-UNK-5d7c542f-1
0.477
ALP-POS-6f6ae286-3
0.477
EDJ-MED-c3ea9889-6
0.476
PET-UNK-0d6841fa-1
0.473
PET-UNK-4b4f2bb7-5
0.472
ALP-POS-6f6ae286-2
0.472
EDG-MED-b8f93667-7
0.470
PET-UNK-ff046148-4
0.469
EDJ-MED-3bfd841e-1
0.469
EDJ-MED-841e0cf0-4
0.467
EDJ-MED-670ad2ee-4
0.467
PET-UNK-ff046148-2
0.465
PET-UNK-b38839dc-23
0.464
PET-UNK-407a74a5-10
0.463
EDG-MED-b8f93667-5
0.461
PET-UNK-f4e47ebd-25
0.459
PET-UNK-407a74a5-11
0.459
PET-UNK-81b485b5-6
0.459
PET-UNK-81b485b5-20
0.459
EDG-MED-b8f93667-1
0.457
EDJ-MED-ede277f6-10
0.454
EDJ-MED-be9e6f63-2
0.453
EDJ-MED-7889e8da-2
0.453
PET-UNK-ff046148-3
0.453
PET-UNK-f4e47ebd-26
0.451
PET-UNK-bcc8fd08-3
0.450
PET-UNK-c65ea24c-6
0.450
MAT-POS-64942dd0-4
0.450
ALP-POS-6f6ae286-6
0.448
BEN-DND-f06bfa8e-3
0.448
PET-UNK-c65ea24c-7
0.448
FRA-DIA-6238d354-1
0.446
EDJ-MED-923a35c2-1
0.446
EDJ-MED-923a35c2-4
0.445
EDJ-MED-dac03e7f-6
0.445
EDJ-MED-ede277f6-1
0.442
EDJ-MED-dac03e7f-5
0.442
EDJ-MED-dac03e7f-8
0.442
ALP-POS-6f6ae286-4
0.442
EDJ-MED-0186a59b-1
0.439
ALP-POS-6f6ae286-5
0.439
BEN-DND-f06bfa8e-2
0.439
EDJ-MED-7889e8da-1
0.439
PET-UNK-b566c0b0-8
0.439
EDJ-MED-dac03e7f-7
0.438
PET-UNK-1e13ef09-1
0.435