Molecular Properties | |
SMILES: | C=CC(=O)N1CCN(C2(c3cccc(Cl)c3)CCO2)CC1 |
MW: | 306.793 |
Fraction sp3: | 0.44 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 32.78 |
cLogP: | 2.2433 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-04-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Oxetanes, thietanes
AAR-POS-d2a4d1df-1
MED-COV-4280ac29-11
0.721
JOH-UNI-27ac80fd-34
0.485
MED-COV-4280ac29-14
0.433
SAD-SAT-b55127ae-1
0.423
MED-COV-4280ac29-12
0.417
MAK-UNK-6ca90168-13
0.414
MAK-UNK-ec98eaf6-3
0.412
SAD-SAT-1f400d17-6
0.348
JOH-UNI-27ac80fd-33
0.342
SAD-SAT-1f400d17-1
0.333
SAD-SAT-c989feaa-7
0.329
MAT-POS-4e253971-2
0.325
SAD-SAT-581007d4-8
0.320
AHN-SAT-02ef6d10-3
0.319
MAK-UNK-10dfa458-2
0.315
JAG-SYN-9c2cd0bd-1
0.311
BEN-DND-03ad4429-7
0.311
MAK-UNK-10dfa458-4
0.311
JOH-UNI-0e1753c1-2
0.311
MAK-UNK-6ca90168-12
0.310
MAK-UNK-6ca90168-21
0.310
DAV-IMP-59dd6621-23
0.307
ANT-OPE-d972fbad-1
0.306
BEN-DND-03ad4429-3
0.303
MAK-UNK-10dfa458-5
0.303
AHN-SAT-02ef6d10-10
0.303
MAK-UNK-6ca90168-16
0.302
SAD-SAT-c989feaa-6
0.299
JAN-GHE-83b26c96-20
0.298
EDG-MED-0da5ad92-11
0.298
MAK-UNK-10dfa458-18
0.297
SEA-TRI-98d2cd42-1
0.296
SAD-SAT-f0a2747f-10
0.295
MAK-UNK-6ca90168-2
0.291
SAD-SAT-b55127ae-10
0.289
PEI-IMP-3d837503-2
0.288
BAR-COM-0f94fc3d-25
0.287
MAK-UNK-ec98eaf6-4
0.286
JOH-UNI-23d9e1b1-1
0.286
STU-CHA-128b80be-2
0.284
JOO-IND-6372a4f3-4
0.284
SAD-SAT-65574d3f-9
0.284
ANT-OPE-c0c3e7cc-1
0.282
MAK-UNK-6ca90168-15
0.280
MAK-UNK-10dfa458-10
0.278
JAN-GHE-4287bd1a-1
0.278
SAD-SAT-2ceae68f-1
0.278
HYO-UNK-49a60884-1
0.276
AHN-SAT-02ef6d10-6
0.276
AAR-POS-d2a4d1df-35
0.276
MED-COV-4280ac29-15
0.276
JOH-UNI-0e1753c1-3
0.276
MED-COV-4280ac29-29
0.275
NAU-LAT-e1818702-5
0.275
JOH-UNI-27ac80fd-26
0.274
MED-COV-4280ac29-6
0.273
STU-CHA-07310c75-1
0.273
SAD-SAT-b55127ae-4
0.273
SAD-SAT-1f400d17-10
0.272
SAD-SAT-2ceae68f-8
0.272
SEA-TRI-078a8df3-1
0.271
JAG-SYN-9c2cd0bd-3
0.269
MAR-TRE-04c86cea-78
0.267
MAK-UNK-10dfa458-1
0.267
SAD-SAT-3a925b8b-10
0.267
NAU-LAT-2fed8305-2
0.267
NAU-LAT-a5c7d7cb-3
0.266
VLA-UCB-05e51b3f-2
0.266
SAD-SAT-6b5a89f0-9
0.263
DRR-IMP-dff87f5e-8
0.263
MAK-UNK-10dfa458-9
0.263
WAR-XCH-79d12f6e-7
0.263
SAD-SAT-1f400d17-4
0.261
NAU-LAT-2fed8305-7
0.261
JOH-UNI-27ac80fd-3
0.260
SAD-SAT-7d5528d9-5
0.258
SAD-SAT-b55127ae-5
0.256
WIL-LEE-1f71e281-4
0.256
EDG-MED-21720aac-4
0.256
UNK-UNK-2ede4078-93
0.256
MAT-POS-d8472c4f-1
0.255
MAT-POS-8695a11f-1
0.255
MAT-POS-8695a11f-3
0.255
EDJ-MED-96f6b92c-1
0.255
AHN-SAT-02ef6d10-7
0.254
JOH-UNI-e19b918c-5
0.254
MAK-UNK-10dfa458-8
0.253
MAT-POS-2db6411e-1
0.253
NAU-LAT-e1818702-6
0.253
JAN-GHE-6413aaf8-9
0.253
WAR-XCH-72a8c209-2
0.250
LUI-IND-a1be81af-2
0.250
BEN-DND-61647d40-19
0.250
TOB-UNK-c2aba166-2
0.250
GIA-UNK-7337c2f3-2
0.250
DAR-DIA-3e9bbd81-12
0.250
DAR-DIA-ecdbc7dd-18
0.250
JAN-GHE-6413aaf8-5
0.247
WAR-XCH-72a8c209-1
0.247
SAD-SAT-c989feaa-3
0.247