Molecular Properties | |
SMILES: | Cn1ccc(=O)cc1C(=O)N1CCN(c2cccc(Cl)c2)CC1 |
MW: | 331.11 |
Fraction sp3: | 0.29 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 45.55 |
cLogP: | 2.0 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-11-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Filter82_pyridinium
MAT-POS-8fd29122-2
0.551
SAD-SAT-65574d3f-9
0.492
UNK-UNK-2ede4078-93
0.467
UNK-UNK-2ede4078-76
0.461
ERI-UCB-a0b0dbcb-2
0.434
MAT-POS-450cb4f9-2
0.429
MAT-POS-54c4bf04-3
0.427
MAT-POS-3b536971-2
0.425
MAR-TRE-a9136c7b-76
0.376
MAT-POS-450cb4f9-1
0.375
SAD-SAT-135344c3-8
0.356
MAR-TRE-d0525fbf-84
0.344
MAT-POS-b5746674-115
0.326
SAD-SAT-5b1897b2-4
0.324
UNK-UNK-2ede4078-45
0.311
UNK-UNK-2ede4078-92
0.311
UNK-UNK-2ede4078-42
0.311
AHN-SAT-02ef6d10-3
0.311
NAU-LAT-56d5284e-1
0.304
MAT-POS-162a9720-2
0.304
NIL-NON-a189c016-1
0.304
UNK-UNK-2ede4078-86
0.303
UNK-UNK-2ede4078-99
0.303
UNK-UNK-2ede4078-79
0.301
UNK-UNK-2ede4078-69
0.301
MIC-UNK-c5a20098-1
0.297
DAR-DIA-5d6f1b43-20
0.294
NAU-LAT-56d5284e-4
0.292
JAN-GHE-82a280f8-1
0.292
BEN-DND-7e92b6ca-15
0.290
MED-COV-4280ac29-14
0.289
MAK-UNK-6ca90168-15
0.289
UNK-UNK-2ede4078-15
0.287
NAU-LAT-56d5284e-5
0.287
UNK-UNK-2ede4078-24
0.287
ERI-UCB-a0b0dbcb-3
0.284
MAR-UCB-f313ec4d-5
0.284
BEN-DND-7e92b6ca-12
0.284
ERI-UCB-a0b0dbcb-4
0.281
JOH-UNI-23d9e1b1-1
0.278
EDJ-MED-d1cd9639-2
0.273
EDJ-MED-d1cd9639-1
0.273
DAN-LON-a5fc619e-2
0.271
PET-UNK-752bebd6-1
0.270
WIL-LEE-23e8b574-8
0.267
PAT-UNK-b2d83456-3
0.265
DAR-DIA-5d6f1b43-19
0.264
NAU-LAT-56d5284e-7
0.260
MAT-POS-54c4bf04-4
0.260
ERI-UCB-ce40166b-21
0.260
DAR-DIA-1a77c53a-1
0.257
EDJ-MED-78f964c8-1
0.256
MAT-POS-916a2c5a-4
0.256
SAD-SAT-c989feaa-3
0.256
ERI-UCB-d6de1f3c-2
0.255
ERI-UCB-d6de1f3c-1
0.255
DAR-DIA-5d6f1b43-18
0.255
KOV-VNK-5e1a909f-49
0.255
MED-COV-4280ac29-15
0.253
JOH-UNI-0e1753c1-3
0.253
HYO-UNK-49a60884-1
0.253
AAR-POS-d2a4d1df-35
0.253
JOH-UNI-0e1753c1-2
0.253
MED-COV-4280ac29-12
0.253
MED-COV-4280ac29-29
0.253
SAD-SAT-c989feaa-10
0.253
NAU-LAT-56d5284e-6
0.253
MIC-UNK-02d7a284-1
0.252
MED-COV-4280ac29-6
0.250
JOH-UNI-0e1753c1-1
0.250
EDJ-MED-e66f2cc5-2
0.250
NAU-LAT-a5c7d7cb-6
0.250
MIC-UNK-9582b2c5-3
0.248
JAG-UCB-4709a583-1
0.248
MAK-UNK-6ca90168-13
0.247
MIC-UNK-c5a20098-2
0.245
PET-UNK-5eca9d1d-3
0.244
PET-UNK-e274cad4-6
0.242
MED-COV-4280ac29-18
0.241
KOV-VNK-5e1a909f-48
0.241
MIC-UNK-02d7a284-2
0.241
DRR-IMP-dff87f5e-8
0.241
SAD-SAT-b55127ae-1
0.241
DAR-DIA-093892e4-11
0.240
JAR-KUA-8c13982c-20
0.240
UNK-UNK-2ede4078-75
0.240
WAR-XCH-b6889685-7
0.239
JAG-UCB-cedd89ab-1
0.239
MAR-UCB-f313ec4d-6
0.239
NAU-LAT-e1818702-7
0.238
JAG-UCB-a3ef7265-17
0.238
CAR-INS-33b3c115-2
0.238
NAU-LAT-56d5284e-3
0.238
MIC-UNK-c5a20098-3
0.238
KOV-VNK-5e1a909f-50
0.237
BEN-DND-7e92b6ca-13
0.237
BEN-DND-7e92b6ca-11
0.237
KRI-MAR-d2e3ef86-13
0.237
BEN-DND-7e92b6ca-14
0.237
UNK-UNK-2ede4078-53
0.237