Molecular Properties | |
SMILES: | O=C(Nc1ccc(Cl)cc1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O |
MW: | 376.1 |
Fraction sp3: | 0.09 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 49.41 |
cLogP: | 4.68 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.5 |
IC50 (µM) - RapidFire: | 65.0200250558461 |
Order Status | |
Shipped: | 2020-12-09 |
LON-WEI-b2874fec-15
0.815
LON-WEI-b2874fec-19
0.809
LON-WEI-b2874fec-18
0.722
LON-WEI-b2874fec-24
0.684
LON-WEI-b2874fec-25
0.671
MAR-TRE-f6f5f473-31
0.671
LON-WEI-5e7d1b3e-19
0.582
LON-WEI-4d77710c-19
0.582
LON-WEI-b2874fec-17
0.580
LON-WEI-b2874fec-23
0.573
LON-WEI-b2874fec-22
0.562
LON-WEI-b2874fec-20
0.557
LON-WEI-f8a636e2-1
0.524
LON-WEI-b2874fec-21
0.518
LON-WEI-b2874fec-27
0.512
LON-WEI-b2874fec-26
0.430
MAR-TRE-e86a56b5-5
0.357
MAR-TRE-f6f5f473-8
0.330
MAR-TRE-e86a56b5-84
0.322
JOH-UNI-c7afdb96-1
0.304
MAR-TRE-74c6519b-63
0.303
MAR-TRE-2fd8122f-90
0.290
MAT-POS-ea426761-62
0.287
MAR-TRE-74c6519b-42
0.284
GIA-UNK-7337c2f3-1
0.276
ALP-POS-568d9d36-1
0.276
LON-WEI-d1c9908a-2
0.269
LON-WEI-120e5cf5-20
0.267
LON-WEI-b8d98729-24
0.264
JON-UNI-4b544d07-5
0.264
NAU-LAT-a5c7d7cb-6
0.257
LON-WEI-b8d98729-22
0.257
WAR-XCH-b0339bbe-20
0.256
WAR-XCH-79d12f6e-10
0.256
LON-WEI-b8d98729-33
0.255
CHR-SOS-7098f804-7
0.253
WIL-UNI-a125ac6f-1
0.252
MAK-UNK-0cb6a3ad-11
0.250
EDJ-MED-c292668a-1
0.247
MAR-TRE-7f7bb9f0-74
0.247
MAR-TRE-a3327163-48
0.244
LON-WEI-b8d98729-11
0.243
DRA-CSI-47e38074-9
0.242
LON-WEI-b8d98729-21
0.241
EDJ-MED-c292668a-3
0.240
BEN-DND-031a96cc-2
0.240
BEN-DND-03406596-4
0.238
BEN-DND-93268d01-1
0.238
BEN-DND-03406596-11
0.238
BEN-DND-03406596-12
0.238
CAS-DEP-751a2458-4
0.237
WIL-UNI-5578df48-9
0.237
ROB-UNI-daaf9793-3
0.237
JOH-UNI-c7afdb96-2
0.236
BEN-DND-031a96cc-6
0.236
EDJ-MED-c292668a-2
0.236
MAR-TRE-6c5ef77a-85
0.235
MAR-LAB-efb042c5-2
0.235
AAR-POS-0daf6b7e-44
0.235
BEN-DND-f6031113-14
0.233
JAN-GHE-d851b096-2
0.232
JAR-IMP-ed466bb3-4
0.231
BEN-DND-f6031113-20
0.231
LON-WEI-b8d98729-44
0.231
JOH-UNI-c7afdb96-4
0.231
CAS-DEP-e179b1f5-3
0.230
FAR-UNI-736b943a-3
0.230
BEN-DND-f6031113-7
0.230
CHR-SOS-7098f804-13
0.229
JON-UNI-2a110085-5
0.227
MAR-TRE-6a44bbf2-86
0.227
LON-WEI-120e5cf5-15
0.227
SAD-SAT-2fd372d1-8
0.226
MAR-TRE-3e4e6814-93
0.226
WAR-XCH-b0339bbe-12
0.225
WAR-XCH-79d12f6e-1
0.225
UNK-UNK-2ede4078-10
0.224
RAL-MED-9a5eb9cb-3
0.224
BEN-DND-f6031113-4
0.224
AHN-SAT-de2502ba-7
0.224
MAK-UNK-5d2caa6f-16
0.223
FAR-UNI-736b943a-7
0.222
AAR-POS-fca48359-9
0.222
BEN-DND-fa51d92c-14
0.221
MAR-LAB-ff9967db-30
0.221
WIL-UNI-1faa9b10-4
0.221
CHR-SOS-7098f804-14
0.221
AAR-UNI-c25c2f1e-51
0.220
BEN-DND-f6031113-17
0.220
KEI-TRE-d5e2018a-99
0.219
MAR-TRE-67513f76-32
0.219
AUS-ARG-7cfdce8f-11
0.218
JOH-UNI-c7afdb96-12
0.218
BRU-UNI-418e22dc-6
0.218
BEN-DND-f6031113-10
0.218
BEN-DND-f6031113-18
0.218
BEN-DND-f6031113-11
0.218
JAR-IMP-ed466bb3-9
0.217
CHR-SOS-7098f804-8
0.217
JOH-UNI-6b98e24c-2
0.217