Molecular Properties | |
SMILES: | O=C(Cc1c[nH]c2ncccc12)NCc1cc(Cl)ccn1 |
MW: | 300.749 |
Fraction sp3: | 0.13 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 70.67 |
cLogP: | 2.4702 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z1575152133 |
Enamine Extended REAL: | s_527____8124854____7024786 |
MolPort: | MolPort-047-314-859 |
Order Status | |
Ordered: | 2020-03-31 |
Synthesis Location: | enamine |
Shipped: | 2020-04-09 |
4-halopyridine
TRY-UNI-1fd04853-10
0.676
TRY-UNI-1fd04853-11
0.653
TRY-UNI-1fd04853-5
0.630
TRY-UNI-1fd04853-7
0.620
TRY-UNI-1fd04853-12
0.564
DAR-DIA-23aa0b97-12
0.553
TRY-UNI-1fd04853-8
0.532
TRY-UNI-1fd04853-6
0.525
MAR-TRE-3159af1a-41
0.506
KAL-WAB-eb347ebe-1
0.493
MAR-TRE-3159af1a-9
0.481
MAR-TRE-3159af1a-33
0.475
MAR-TRE-3159af1a-8
0.474
ANT-DIA-3c79be55-1
0.469
NIC-BIO-25446079-1
0.468
NAU-LAT-81109c57-7
0.462
IND-SYN-6c8299e8-5
0.456
IND-SYN-3aa4e743-1
0.456
DAR-DIA-23aa0b97-1
0.452
NIC-BIO-25446079-3
0.451
MAK-UNK-b1917cc8-5
0.443
DAR-DIA-23aa0b97-2
0.442
AAR-POS-d2a4d1df-20
0.438
MAR-TRE-3159af1a-76
0.435
NIC-BIO-25446079-2
0.432
MAR-UCB-195bc32d-13
0.427
ANT-DIA-3c79be55-3
0.422
SWA-SYN-6423ea73-10
0.422
SWA-SYN-d2e6fa14-9
0.422
NIC-BIO-25446079-4
0.422
NIC-BIO-3276ca7f-6
0.413
PET-SGC-fc67af9f-1
0.408
SAD-SAT-f25ee457-5
0.407
MAR-TRE-3159af1a-40
0.404
RED-RED-10c9212c-49
0.402
NIC-BIO-3276ca7f-5
0.396
NIC-BIO-29f4a211-1
0.391
MAR-TRE-3159af1a-37
0.389
MAR-TRE-3159af1a-90
0.389
TAM-UNI-c140e31a-17
0.384
ZAC-WAB-2baeb60f-1
0.383
ZAC-WAB-d55a3c2e-1
0.383
NIC-BIO-3276ca7f-4
0.378
NIC-BIO-29f4a211-2
0.378
NIC-BIO-ec630548-1
0.378
NIC-BIO-ec630548-2
0.374
SWA-SYN-d2e6fa14-4
0.372
SWA-SYN-6423ea73-4
0.372
TAM-UNI-c140e31a-5
0.371
MAR-TRE-3159af1a-70
0.371
NIC-BIO-ec630548-4
0.370
MAR-TRE-3159af1a-66
0.366
NIC-BIO-ec630548-3
0.366
MAR-TRE-3159af1a-99
0.364
TAM-UNI-c140e31a-4
0.364
TAM-UNI-c140e31a-8
0.360
MAK-UNK-10572812-8
0.358
SAD-SAT-f25ee457-10
0.357
TAM-UNI-c140e31a-18
0.356
MAK-UNK-de8f6d00-7
0.356
ASH-UNK-40b46b30-18
0.354
MAK-UNK-10572812-12
0.352
MAR-TRE-3159af1a-84
0.351
NIC-BIO-96ee2ca4-1
0.351
MAR-TRE-3159af1a-75
0.350
MAR-TRE-3159af1a-1
0.350
NIC-BIO-3276ca7f-1
0.348
MAR-TRE-3159af1a-16
0.347
MAK-UNK-de8f6d00-2
0.346
MAK-UNK-10572812-9
0.346
BEN-BAS-bb561ced-1
0.345
NIC-BIO-f814dd3d-1
0.343
MAR-TRE-3159af1a-21
0.343
MAR-TRE-3159af1a-44
0.343
SHR-UNK-cde60afe-1
0.343
JON-UNI-57097b3f-2
0.341
MAR-UCB-195bc32d-10
0.341
MAR-TRE-3159af1a-2
0.340
MAK-UNK-de8f6d00-3
0.340
MAK-UNK-de8f6d00-8
0.340
MAK-UNK-10572812-10
0.339
MAK-UNK-10572812-1
0.339
SAD-SAT-f25ee457-6
0.337
MAK-UNK-de8f6d00-1
0.337
MAK-UNK-10572812-11
0.336
MAK-UNK-10572812-13
0.333
ASH-UNK-40b46b30-14
0.330
MAR-TRE-3159af1a-24
0.330
MAK-UNK-10572812-7
0.328
MAK-UNK-de8f6d00-5
0.327
GAB-FRA-261eb2a6-1
0.327
MAK-UNK-de8f6d00-6
0.324
TAM-UNI-c140e31a-9
0.324
NIC-BIO-96ee2ca4-2
0.321
PET-UNK-3c72d439-1
0.319
MAK-UNK-10572812-2
0.319
ZAC-WAB-86e8bacf-1
0.314
MAR-TRE-3159af1a-20
0.313
MAR-TRE-3159af1a-58
0.310
MAK-UNK-10572812-6
0.305