Molecular Properties | |
SMILES: | CN(C)c1ccc(N(Cc2cccc(Cl)c2)C(=O)Cn2nnc3ccccc32)cc1 |
MW: | 419.15 |
Fraction sp3: | 0.17 |
HBA: | 5 |
HBD: | 0 |
Rotatable Bonds: | 6 |
TPSA: | 54.26 |
cLogP: | 4.38 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.496758543375736 |
IC50 (µM) - RapidFire: | 0.39149145875568 |
Order Status | |
Ordered: | 2020-08-25 |
Synthesis Location: | sai |
Shipped: | 2020-11-17 |
N,N-Dialkyl aniline derivatives (2)
ALP-POS-6d04362c-2
1.000
ALP-POS-bad7201a-15
1.000
CHO-MSK-00c5269a-1
0.821
CHO-MSK-00c5269a-2
0.790
DAR-DIA-093892e4-7
0.782
DAR-DIA-093892e4-11
0.768
ALP-POS-75715966-5
0.768
DAR-DIA-093892e4-12
0.750
DAR-DIA-093892e4-5
0.747
ALP-POS-6d04362c-1
0.731
ALP-POS-75715966-1
0.721
CHO-MSK-00c5269a-4
0.716
CHO-MSK-00c5269a-5
0.716
DAR-DIA-093892e4-1
0.713
DAR-DIA-093892e4-9
0.713
DAR-DIA-093892e4-6
0.701
DAR-DIA-093892e4-3
0.701
DAR-DIA-093892e4-8
0.697
ALP-POS-d2866bdf-1
0.687
DAR-DIA-093892e4-2
0.685
DAR-DIA-093892e4-10
0.678
EDJ-MED-06d94977-2
0.671
MAT-POS-06036648-1
0.624
PET-UNK-1901c25b-3
0.609
PET-UNK-7374c256-2
0.609
ALP-POS-87c86d55-1
0.609
PET-UNK-b75fdf9f-1
0.605
DAR-DIA-093892e4-4
0.600
RUT-UNI-630c5802-26
0.559
ALP-POS-c59291d4-4
0.543
ALP-POS-bad7201a-14
0.538
ALP-POS-bad7201a-5
0.538
RAL-THA-4a5dabff-1
0.534
OLG-UNK-911c2067-1
0.533
PET-UNK-1901c25b-2
0.532
RAL-THA-4a5dabff-2
0.532
RUT-UNI-630c5802-24
0.526
ALP-POS-c0c213c9-6
0.526
ALP-POS-c59291d4-1
0.521
ALP-POS-6d04362c-5
0.516
RUT-UNI-630c5802-27
0.515
MAT-POS-06036648-2
0.510
MAD-UNK-84a4f939-1
0.510
MAD-UNK-b1ea4171-1
0.510
ROB-IMP-e811baff-1
0.510
MAT-POS-06036648-5
0.505
ALP-POS-c59291d4-2
0.505
VLA-UCB-34f3ed0c-2
0.500
ALP-POS-6d04362c-4
0.490
ALP-POS-6d04362c-3
0.490
ALP-POS-7c842ab8-1
0.490
MAT-POS-3b92565d-13
0.489
ALP-POS-c59291d4-3
0.476
RAL-THA-4a5dabff-3
0.474
ALP-POS-75715966-4
0.473
RUT-UNI-630c5802-25
0.472
RUT-UNI-630c5802-1
0.471
MAT-POS-06036648-3
0.470
RUT-UNI-630c5802-5
0.467
RAL-THA-4a5dabff-8
0.466
DAR-DIA-667e571f-2
0.463
MAT-POS-ffe83904-1
0.459
RUT-UNI-630c5802-9
0.458
MAR-LAB-ca4662a6-7
0.458
ALP-POS-75715966-2
0.455
PET-UNK-b75fdf9f-2
0.454
ALP-POS-c0c213c9-18
0.450
ALP-POS-75715966-3
0.450
ALP-POS-87c86d55-2
0.447
UNK-UNK-2ede4078-94
0.446
MAT-POS-bfb445d4-1
0.438
BEN-DND-61647d40-12
0.438
MAT-POS-3b92565d-14
0.438
BEN-DND-02317c5c-12
0.438
AAR-POS-8a4e0f60-1
0.436
ALP-POS-c0c213c9-15
0.430
RAL-THA-4a5dabff-5
0.430
EDJ-MED-06d94977-1
0.426
RUT-UNI-630c5802-13
0.422
RUT-UNI-630c5802-21
0.420
PET-UNK-b75fdf9f-3
0.419
RUT-UNI-630c5802-17
0.414
RUT-UNI-630c5802-18
0.414
PET-UNK-7374c256-1
0.414
ALP-POS-8ed8d9ec-7
0.414
MAT-POS-06036648-6
0.413
UNK-UNK-2ede4078-29
0.413
RUT-UNI-630c5802-22
0.412
RUT-UNI-630c5802-20
0.406
ALP-POS-c0c213c9-3
0.406
DAR-DIA-667e571f-7
0.404
MAR-LAB-ff9967db-30
0.400
WIL-UNI-2e73223c-2
0.398
RUT-UNI-630c5802-19
0.396
HOL-KAN-828c7b64-1
0.389
HOL-KAN-47917554-1
0.388
MAT-POS-06036648-9
0.388
UNK-UNK-2ede4078-81
0.388
MAT-POS-06036648-4
0.387
AAR-POS-8a4e0f60-8
0.387