Molecular Properties | |
SMILES: | COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2ccc(Cl)cc12 |
MW: | 372.09 |
Fraction sp3: | 0.16 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 6 |
TPSA: | 80.42 |
cLogP: | 3.0 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z1171675407 |
Enamine Extended REAL: | s_22____58494____4145150 |
MolPort: | MolPort-047-551-790 |
Order Status | |
Ordered: | 2020-05-17 |
Synthesis Location: | enamine |
Shipped: | 2020-06-16 |
Aliphatic long chain
AAR-POS-d2a4d1df-1
MAT-POS-916a2c5a-2
0.688
MAT-POS-590ac91e-43
0.628
MAT-POS-590ac91e-32
0.616
MAT-POS-590ac91e-53
0.604
ALP-POS-05819dc4-1
0.584
EDJ-MED-6af13d92-3
0.581
EDJ-MED-6af13d92-2
0.562
EDJ-MED-6af13d92-1
0.544
ALP-POS-3fc1724e-1
0.516
MAT-POS-35d3f55a-2
0.505
MAT-POS-3b536971-1
0.500
EDJ-MED-edeb0d3a-2
0.500
DAR-DIA-8e329c92-3
0.494
DAR-DIA-8e329c92-2
0.489
JOH-UNI-abfda500-3
0.489
BEN-DND-7e92b6ca-1
0.476
DAR-DIA-8e329c92-1
0.467
EDJ-MED-bbe8e3da-2
0.465
EDJ-MED-bbe8e3da-4
0.465
NAU-LAT-a5c7d7cb-7
0.462
MAT-POS-8fd29122-1
0.459
MAT-POS-590ac91e-41
0.454
EDJ-MED-bbe8e3da-1
0.452
MAR-UCB-f313ec4d-2
0.446
MAT-POS-91829f0d-1
0.446
MAT-UCB-70f7c0f7-1
0.446
MAT-POS-590ac91e-47
0.443
VLA-UNK-eaa804fd-3
0.443
MAT-POS-590ac91e-39
0.439
PET-UNK-752bebd6-1
0.438
BEN-DND-7e92b6ca-5
0.438
ALP-POS-fc6c627f-3
0.437
BEN-DND-7e92b6ca-2
0.436
DAR-DIA-8e329c92-6
0.433
MAT-POS-590ac91e-54
0.433
ERI-UCB-ce40166b-25
0.429
ERI-UCB-ce40166b-18
0.421
EDJ-MED-bbe8e3da-3
0.420
MAR-UCB-f313ec4d-4
0.417
DAR-DIA-8e329c92-4
0.414
ERI-UCB-ce40166b-20
0.407
ALP-POS-3fc1724e-2
0.406
ERI-UCB-ce40166b-17
0.406
MAT-UCB-70f7c0f7-2
0.398
ERI-UCB-ce40166b-19
0.398
MAT-POS-590ac91e-51
0.398
DAR-DIA-8e329c92-5
0.398
EDJ-MED-edeb0d3a-1
0.392
BEN-DND-b89db3f2-5
0.392
MAR-UCB-f313ec4d-1
0.392
MAT-POS-590ac91e-55
0.390
MAT-POS-590ac91e-37
0.390
ERI-UCB-ce40166b-15
0.387
MAT-POS-54c4bf04-2
0.386
DAR-DIA-8e329c92-7
0.383
ERI-UCB-ce40166b-14
0.383
ERI-UCB-ce40166b-16
0.383
MAT-POS-590ac91e-40
0.382
BEN-DND-b89db3f2-4
0.376
ERI-UCB-ce40166b-13
0.374
MAT-UCB-70f7c0f7-4
0.370
MAT-POS-590ac91e-58
0.370
DAR-DIA-9e4459de-22
0.367
DAR-DIA-8e329c92-8
0.366
MAT-POS-590ac91e-46
0.366
ADA-UCB-b1b30a00-2
0.365
DAR-DIA-9e4459de-23
0.360
MAT-POS-590ac91e-70
0.359
DAR-DIA-9e4459de-18
0.357
DAR-DIA-9e4459de-21
0.357
DAR-DIA-9e4459de-19
0.357
MAT-POS-590ac91e-38
0.356
ADA-UCB-6c2cb422-8
0.355
MAT-UCB-70f7c0f7-3
0.352
EDJ-MED-edeb0d3a-3
0.352
MAT-POS-590ac91e-66
0.350
MAT-POS-35d3f55a-1
0.347
DAR-DIA-9e4459de-20
0.345
DAR-DIA-9e4459de-17
0.343
BEN-DND-7e92b6ca-4
0.337
MAT-POS-590ac91e-30
0.336
BEN-DND-7e92b6ca-3
0.333
DAR-DIA-9e4459de-24
0.333
VLA-UNK-eaa804fd-2
0.333
DAR-DIA-8e329c92-10
0.330
ADA-UCB-b1b30a00-1
0.327
NAU-LAT-56d5284e-6
0.324
MAT-POS-590ac91e-35
0.321
VLA-UNK-eaa804fd-1
0.320
MAT-POS-e1b5ac6b-2
0.320
NAU-LAT-56d5284e-7
0.320
MAT-POS-3b92565d-4
0.320
EDJ-MED-d1cd9639-1
0.318
DAR-DIA-8e329c92-9
0.317
ERI-UCB-a0b0dbcb-9
0.311
ERI-UCB-a0b0dbcb-6
0.306
MAT-POS-590ac91e-48
0.304
MAT-POS-590ac91e-33
0.303
DAR-DIA-1a77c53a-1
0.303
ALP-POS-bea7b391-1
0.300