Molecular Properties | |
SMILES: | O=C(CCCBr)Nc1cccnc1 |
MW: | 243.104 |
Fraction sp3: | 0.33 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 41.99 |
cLogP: | 2.1952 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-03-31 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Filter9_metal
Filter75_alkyl_Br_I
Alkyl Halide
JOH-IMS-62aeb97d-5
0.609
MAR-TRE-67513f76-81
0.600
MAK-UNK-ca11b4f7-1
0.574
MAR-TRE-04c86cea-31
0.522
MAR-TRE-3e4e6814-28
0.515
ALE-HEI-f28a35b5-15
0.509
SAN-PRS-52b81272-2
0.500
MAR-TRE-67513f76-87
0.492
SAD-SAT-24589cd1-4
0.491
MAK-UNK-ca11b4f7-2
0.490
KEI-TRE-d5e2018a-92
0.485
AAR-POS-d2a4d1df-13
0.483
FRA-FAC-9ed5a63a-1
0.483
ALE-HEI-f28a35b5-9
0.483
MAK-UNK-a7b37c5e-4
0.482
MAR-TRE-04c86cea-93
0.478
MAR-TRE-3e4e6814-59
0.478
MAR-TRE-3e4e6814-67
0.477
MAR-TRE-04c86cea-97
0.476
MAR-TRE-3e4e6814-50
0.476
MED-UNK-e6e8ef8a-4
0.475
MED-UNK-e6e8ef8a-5
0.475
MED-UNK-e6e8ef8a-6
0.475
DAR-DIA-842b4336-11
0.475
AUS-ARG-7cfdce8f-11
0.474
MAK-UNK-a7b37c5e-5
0.474
FRA-FAC-9ed5a63a-2
0.467
MED-UNK-e6e8ef8a-2
0.467
MED-UNK-e6e8ef8a-3
0.467
DAR-DIA-842b4336-10
0.466
MAK-UNK-ca11b4f7-3
0.460
MAR-TRE-2fd8122f-20
0.459
CHR-SOS-f7373dd1-5
0.459
MAR-TRE-4b834d9a-97
0.458
MAR-TRE-2fd8122f-62
0.458
MAK-UNK-c749d764-17
0.458
DAR-DIA-23aa0b97-16
0.458
MAK-UNK-a7b37c5e-1
0.458
ALE-HEI-f28a35b5-12
0.456
MAK-UNK-d1e89583-1
0.456
MAR-TRE-b77b7921-80
0.456
MAR-TRE-2fd8122f-72
0.456
MAR-TRE-9c797165-48
0.456
MAR-TRE-9c797165-12
0.456
CHA-MCP-85291e1d-4
0.455
DAR-DIA-842b4336-12
0.450
DAR-DIA-842b4336-13
0.450
EDG-MED-0da5ad92-2
0.450
ALE-HEI-f28a35b5-5
0.450
MAR-TRE-74c6519b-42
0.449
MAR-TRE-b77b7921-74
0.448
MAR-TRE-4b834d9a-82
0.446
MAR-TRE-fd17a9b8-39
0.446
MAR-TRE-67513f76-97
0.444
MAR-TRE-d0525fbf-91
0.444
CHR-SOS-f7373dd1-2
0.444
CHR-SOS-70e4c98a-6
0.444
MAR-TRE-7f7bb9f0-81
0.443
MAR-TRE-9c797165-57
0.443
MAR-TRE-74c6519b-81
0.443
DAR-DIA-842b4336-16
0.443
MAK-UNK-a7b37c5e-2
0.443
MAR-TRE-74c6519b-58
0.441
MAR-TRE-67513f76-73
0.438
CHR-SOS-f7373dd1-4
0.438
CHR-SOS-59746812-2
0.438
MAR-TRE-7f7bb9f0-46
0.438
MAR-TRE-7f7bb9f0-49
0.435
MAR-TRE-7f7bb9f0-74
0.435
MAK-UNK-c749d764-27
0.435
JOH-IMS-62aeb97d-3
0.433
DAR-DIA-842b4336-2
0.431
MAR-TRE-2fd8122f-27
0.431
CHR-SOS-59746812-6
0.431
CHR-SOS-70e4c98a-8
0.431
MAR-TRE-7f7bb9f0-82
0.431
MAR-TRE-67513f76-93
0.429
MAR-TRE-7f7bb9f0-56
0.429
DAR-DIA-842b4336-14
0.429
AAR-POS-d2a4d1df-11
0.426
MAR-TRE-9c797165-52
0.424
CHR-SOS-59746812-1
0.424
MAK-UNK-c749d764-13
0.424
MAK-UNK-c749d764-14
0.424
CHR-SOS-f7373dd1-1
0.424
ALE-HEI-f28a35b5-16
0.424
JOH-IMS-62aeb97d-4
0.424
KEI-TRE-d5e2018a-68
0.423
MAR-TRE-2fd8122f-57
0.422
MAR-TRE-2fd8122f-78
0.422
CHR-SOS-70e4c98a-3
0.418
MAR-TRE-74c6519b-91
0.418
CHR-SOS-59746812-5
0.418
NAU-LAT-64f4b287-10
0.418
MAR-TRE-2fd8122f-100
0.418
MAR-TRE-3e4e6814-61
0.417
DAR-DIA-842b4336-15
0.415
ANN-UNI-26382800-5
0.415
MAR-TRE-74c6519b-47
0.415
DAR-DIA-23aa0b97-17
0.415