Molecular Properties | |
SMILES: | Cc1ccccc1CNC(=O)Cn1c(=O)n(-c2ccc(F)cc2)c2ncccc21 |
MW: | 390.15 |
Fraction sp3: | 0.14 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 68.92 |
cLogP: | 2.95 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-3984653685 |
MolPort: | MolPort-028-859-052 |
MAR-TRE-f6f5f473-68
0.825
MAR-TRE-4b834d9a-54
0.759
MAR-TRE-4b834d9a-76
0.750
MAR-TRE-9c797165-85
0.690
MAR-TRE-d0525fbf-21
0.690
MAR-TRE-4b834d9a-60
0.687
MAR-TRE-9c797165-23
0.686
MAR-TRE-3e4e6814-73
0.682
MAR-TRE-7f7bb9f0-22
0.682
MAR-TRE-74c6519b-30
0.678
MAR-TRE-f6f5f473-12
0.663
MAR-TRE-67513f76-11
0.655
MAR-TRE-d0525fbf-71
0.649
MAR-TRE-74c6519b-70
0.648
MAR-TRE-7f7bb9f0-73
0.642
MAR-TRE-f6f5f473-17
0.640
MAR-TRE-4b834d9a-35
0.640
MAR-TRE-9c797165-78
0.640
MAR-TRE-04c86cea-70
0.637
MAR-TRE-4b834d9a-69
0.633
MAR-TRE-7f7bb9f0-70
0.630
MAR-TRE-b77b7921-20
0.624
MAR-TRE-d0525fbf-3
0.624
MAR-TRE-7f7bb9f0-78
0.619
MAR-TRE-04c86cea-45
0.618
MAR-TRE-3e4e6814-4
0.617
MAR-TRE-d0525fbf-70
0.611
MAR-TRE-d0525fbf-37
0.609
MAR-TRE-04c86cea-52
0.607
MAR-TRE-d0525fbf-68
0.604
MAR-TRE-b77b7921-59
0.600
MAR-TRE-d0525fbf-12
0.596
MAR-TRE-b77b7921-27
0.591
MAR-TRE-04c86cea-69
0.589
MAR-TRE-d0525fbf-2
0.588
MAR-TRE-b77b7921-43
0.585
MAR-TRE-67513f76-62
0.585
MAR-TRE-4b834d9a-36
0.585
MAR-TRE-67513f76-23
0.584
MAR-TRE-d0525fbf-44
0.582
MAR-TRE-7f7bb9f0-1
0.582
MAR-TRE-74c6519b-78
0.580
MAR-TRE-3e4e6814-75
0.580
MAR-TRE-74c6519b-92
0.576
MAR-TRE-f6f5f473-55
0.571
MAR-TRE-7f7bb9f0-71
0.568
MAR-TRE-f6f5f473-22
0.562
MAR-TRE-3e4e6814-86
0.559
MAR-TRE-74c6519b-39
0.548
MAR-TRE-04c86cea-80
0.548
MAR-TRE-7f7bb9f0-3
0.546
MAR-TRE-67513f76-15
0.545
MAR-TRE-74c6519b-10
0.543
MAR-TRE-4b834d9a-23
0.543
MAR-TRE-67513f76-72
0.540
MAR-TRE-f6f5f473-94
0.539
MAR-TRE-f6f5f473-34
0.538
MAR-TRE-3e4e6814-21
0.531
MAR-TRE-04c86cea-60
0.531
MAR-TRE-d0525fbf-8
0.530
MAR-TRE-d0525fbf-89
0.525
MAR-TRE-3e4e6814-20
0.522
MAR-TRE-74c6519b-77
0.520
MAR-TRE-3e4e6814-18
0.511
MAR-TRE-7f7bb9f0-65
0.511
MAR-TRE-b77b7921-29
0.510
MAR-TRE-d0525fbf-9
0.510
MAR-TRE-9c797165-100
0.510
MAR-TRE-04c86cea-21
0.505
MAR-TRE-f6f5f473-20
0.505
MAR-TRE-74c6519b-9
0.505
MAR-TRE-3e4e6814-2
0.505
MAR-TRE-b77b7921-48
0.505
MAR-TRE-04c86cea-33
0.500
MAR-TRE-d0525fbf-79
0.500
MAR-TRE-d0525fbf-6
0.490
MAR-TRE-3e4e6814-60
0.490
MAR-TRE-74c6519b-45
0.485
MAR-TRE-04c86cea-58
0.480
MAR-TRE-f6f5f473-53
0.479
MAR-TRE-3e4e6814-69
0.478
MAR-TRE-3e4e6814-25
0.475
MAR-TRE-4b834d9a-99
0.463
MAR-TRE-3e4e6814-26
0.453
MAR-TRE-4b834d9a-8
0.443
MAR-TRE-4b834d9a-33
0.443
MAR-TRE-f6f5f473-26
0.442
MAR-TRE-4b834d9a-55
0.438
MAR-TRE-4b834d9a-15
0.437
MAR-TRE-04c86cea-25
0.434
MAR-TRE-04c86cea-57
0.433
MAR-TRE-b77b7921-100
0.430
MAR-TRE-d0525fbf-43
0.424
MAR-TRE-4b834d9a-95
0.423
MAR-TRE-74c6519b-16
0.421
MAR-TRE-04c86cea-9
0.421
MAR-TRE-f6f5f473-50
0.419
MAR-TRE-3e4e6814-10
0.418
MAR-TRE-04c86cea-63
0.417
MAR-TRE-3e4e6814-19
0.415