Molecular Properties | |
SMILES: | O=C(Nc1ccccc1O)C1CCN(C(=O)CCl)CC1 |
MW: | 296.754 |
Fraction sp3: | 0.43 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 69.64 |
cLogP: | 1.8081 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine BB: | EN300-36856 |
Enamine SCR: | Z291278934 |
Enamine REAL: | Z291278934 |
Enamine Extended REAL: | m_270062____16424400____8147258 |
Mcule: | MCULE-2578941497 |
MolPort: | MolPort-005-312-414 |
Order Status | |
Shipped: | 2021-04-16 |
catechol
MAR-TRE-6a44bbf2-15
1.000
LON-WEI-120e5cf5-16
0.667
MAK-UNK-3d7e3904-3
0.615
MAK-UNK-3d7e3904-2
0.615
MAR-TRE-6a44bbf2-86
0.583
LON-WEI-120e5cf5-15
0.583
MAK-UNK-a7992eb3-7
0.563
SWA-SYN-d2e6fa14-1
0.541
SWA-SYN-6423ea73-1
0.541
MAK-UNK-a7992eb3-8
0.541
LON-WEI-120e5cf5-14
0.528
LON-WEI-120e5cf5-20
0.524
LON-WEI-120e5cf5-10
0.508
LON-WEI-120e5cf5-11
0.507
MAK-UNK-69bf97dd-4
0.506
JAR-IMP-ed466bb3-12
0.506
MAK-UNK-69bf97dd-5
0.500
MED-COV-4280ac29-17
0.494
MAK-UNK-3f402c2b-19
0.493
MAK-UNK-c97f7c8f-1
0.493
LON-WEI-120e5cf5-18
0.487
LON-WEI-120e5cf5-19
0.486
LON-WEI-120e5cf5-21
0.486
MAK-UNK-750cfbcc-2
0.482
MAK-UNK-a7992eb3-9
0.482
LON-WEI-120e5cf5-12
0.479
MAK-UNK-c97f7c8f-2
0.478
LON-WEI-120e5cf5-13
0.471
LON-WEI-120e5cf5-7
0.463
MAK-UNK-a7992eb3-1
0.460
LON-WEI-120e5cf5-1
0.458
AAR-POS-f650c5f2-4
0.458
AAR-POS-5507155c-2
0.458
LON-WEI-120e5cf5-17
0.458
LON-WEI-120e5cf5-3
0.457
MAK-UNK-a7992eb3-6
0.451
MAK-UNK-a7992eb3-5
0.449
JAR-IMP-ed466bb3-10
0.447
LON-WEI-120e5cf5-4
0.446
MAK-UNK-a7992eb3-2
0.444
SWA-SYN-6423ea73-2
0.441
SWA-SYN-d2e6fa14-2
0.441
JAR-IMP-ed466bb3-17
0.434
LON-WEI-120e5cf5-9
0.432
JAG-SYN-9c2cd0bd-8
0.426
LON-WEI-120e5cf5-2
0.425
MAK-UNK-a7992eb3-4
0.417
SAD-SAT-29425be4-3
0.416
LON-WEI-120e5cf5-5
0.412
MAK-UNK-750cfbcc-1
0.411
SAD-SAT-29425be4-23
0.410
SAD-SAT-29425be4-20
0.408
SAD-SAT-29425be4-14
0.405
AAR-POS-0daf6b7e-5
0.403
MAK-UNK-750cfbcc-3
0.400
MAR-TRE-6a44bbf2-79
0.400
MAK-UNK-69bf97dd-8
0.400
LON-WEI-120e5cf5-6
0.398
MAK-UNK-a7992eb3-3
0.396
YOI-UNK-a533afbc-6
0.395
YOI-UNK-12211982-6
0.395
MAK-UNK-69bf97dd-7
0.390
SAD-SAT-29425be4-15
0.390
SAD-SAT-29425be4-5
0.388
AAR-POS-0daf6b7e-9
0.387
VIR-GIT-7b3d3065-2
0.387
MAK-UNK-750cfbcc-5
0.387
BEN-DND-76ad4ac9-4
0.386
SAD-SAT-29425be4-29
0.386
SAD-SAT-29425be4-6
0.385
SAD-SAT-29425be4-13
0.385
SAD-SAT-29425be4-19
0.385
SAD-SAT-29425be4-28
0.385
MAK-UNK-69bf97dd-6
0.376
JAG-UCB-ef2c0e8e-6
0.373
MAK-UNK-6ca90168-11
0.373
MAK-UNK-69bf97dd-9
0.370
MAR-TRE-6a44bbf2-9
0.370
ASH-SAT-43770c7d-7
0.370
SAD-SAT-29425be4-9
0.369
MAK-UNK-3d7e3904-1
0.368
SAD-SAT-29425be4-25
0.368
SAD-SAT-29425be4-4
0.368
SAD-SAT-29425be4-12
0.366
MAK-UNK-69bf97dd-1
0.365
MAK-UNK-704ed37c-4
0.364
YOI-UNK-15f562e8-1
0.364
JAG-SYN-9c2cd0bd-4
0.362
SAD-SAT-9a6c5cf3-10
0.358
SAD-SAT-d8079f6f-4
0.357
MAK-UNK-212f693e-13
0.357
NIR-THE-0d6461ce-1
0.356
AAR-POS-0daf6b7e-19
0.354
VIR-GIT-7b3d3065-3
0.354
MAK-UNK-69bf97dd-10
0.352
SWA-SYN-d2e6fa14-3
0.351
SWA-SYN-6423ea73-3
0.351
MAK-UNK-69bf97dd-3
0.349
MAK-UNK-704ed37c-1
0.348
MAK-UNK-750cfbcc-4
0.348