Molecular Properties | |
SMILES: | O=C1CC(c2cccc(Cl)c2)C(=O)N1c1cncc2ccccc12 |
MW: | 336.07 |
Fraction sp3: | 0.11 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 50.27 |
cLogP: | 3.94 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
phthalimide
VLA-UCB-1dbca3b4-10
0.714
PET-UNK-689df078-1
0.714
PET-UNK-abc197b8-1
0.650
VLA-UCB-1dbca3b4-18
0.650
PET-UNK-7a31b064-1
0.634
PET-UNK-7a31b064-2
0.631
PET-UNK-689df078-3
0.625
PET-UNK-689df078-2
0.622
VLA-UNK-db5e3064-1
0.622
PET-UNK-689df078-4
0.617
VLA-UCB-1dbca3b4-17
0.600
PET-UNK-4dc48bbe-6
0.600
PET-UNK-7b413b46-6
0.580
PET-UNK-7b413b46-2
0.580
EDG-MED-5d232de5-7
0.573
EDG-MED-5d232de5-8
0.573
GIA-UNK-80c9bc96-1
0.573
PET-UNK-c9c1e0d8-4
0.573
PET-UNK-7b413b46-1
0.571
PET-UNK-7b413b46-5
0.571
VLA-UNK-db5e3064-2
0.561
PET-UNK-c9c1e0d8-3
0.560
PET-UNK-3e354a91-1
0.558
PET-UNK-5ddd54c7-2
0.558
MIC-UNK-0a05c952-1
0.545
VLA-UCB-1dbca3b4-4
0.544
PET-UNK-7b413b46-8
0.540
PET-UNK-7b413b46-4
0.540
MIC-UNK-0a05c952-2
0.539
PET-UNK-7b413b46-3
0.534
PET-UNK-7b413b46-7
0.534
VLA-UCB-1dbca3b4-3
0.506
VLA-UCB-1dbca3b4-8
0.500
MAT-POS-24589f88-14
0.489
BEN-DND-d1eb1f41-7
0.489
VLA-UCB-1dbca3b4-12
0.485
VLA-UCB-1dbca3b4-13
0.483
DAR-DIA-f6ee7aeb-1
0.480
PET-UNK-431b3bfb-1
0.478
ALP-UNI-58319883-2
0.478
PET-UNK-4dc48bbe-8
0.476
DAR-DIA-b80f1cd7-1
0.472
MAT-POS-1f3f1a6f-5
0.465
PET-UNK-194f9da3-1
0.457
MIC-UNK-d854bf4c-1
0.455
DAR-DIA-0f7b7cd9-7
0.453
PET-UNK-5ddd54c7-1
0.453
PET-UNK-194f9da3-2
0.453
DAR-DIA-b80f1cd7-2
0.452
DAR-DIA-f6ee7aeb-6
0.451
MIC-UNK-d854bf4c-5
0.450
DAR-DIA-b80f1cd7-14
0.444
MIC-UNK-d854bf4c-3
0.440
PET-UNK-7be94445-1
0.437
MIC-UNK-d854bf4c-7
0.436
DAR-DIA-b80f1cd7-13
0.434
MIC-UNK-9582b2c5-1
0.431
VLA-UCB-53bdeed6-1
0.430
PET-UNK-7be94445-2
0.430
DAR-DIA-b80f1cd7-10
0.430
DAR-DIA-b80f1cd7-11
0.430
DAR-DIA-b80f1cd7-12
0.426
DAR-DIA-0f7b7cd9-6
0.420
BEN-DND-d1eb1f41-15
0.419
ALP-UNI-dbb9503d-1
0.419
MAT-POS-8695a11f-3
0.418
MAT-POS-8695a11f-1
0.418
DAR-DIA-0f7b7cd9-4
0.418
DAR-DIA-0f7b7cd9-5
0.418
MAT-POS-d8472c4f-1
0.418
DAR-DIA-b80f1cd7-7
0.417
VLA-UNK-c65c1026-4
0.417
VLA-UNK-70dd90ef-1
0.417
VLA-UNK-70dd90ef-3
0.417
VLA-UNK-c65c1026-2
0.414
VLA-UNK-c65c1026-3
0.414
DAR-DIA-b80f1cd7-8
0.413
DAR-DIA-b80f1cd7-9
0.412
DAR-DIA-5d6f1b43-5
0.411
MIC-UNK-50cce87d-9
0.411
VLA-UNK-70dd90ef-2
0.411
MIC-UNK-50cce87d-5
0.409
PET-UNK-e8933450-1
0.409
VLA-UNK-cf7facf1-1
0.408
VLA-UCB-34f3ed0c-11
0.408
VLA-UCB-29506327-1
0.408
DAR-DIA-b80f1cd7-3
0.408
DAR-DIA-b80f1cd7-4
0.408
DAR-DIA-5d6f1b43-1
0.407
MIC-UNK-0a05c952-3
0.404
JOH-MSK-1f2dff76-3
0.404
JOH-MSK-51c67e7d-1
0.404
JOH-MSK-1f2dff76-4
0.404
JOH-MSK-51c67e7d-2
0.404
YVE-CNR-7d92d73e-1
0.404
MAT-POS-90505e2b-1
0.404
MAT-POS-ec6d90b7-1
0.404
MAT-POS-ec6d90b7-2
0.404
DAR-DIA-b80f1cd7-5
0.404
DAR-DIA-b80f1cd7-6
0.404