Molecular Properties | |
SMILES: | N#Cc1ccccc1CN(C1CCC(O)CC1)C1CCN(C(=O)CCl)CC1 |
MW: | 389.927 |
Fraction sp3: | 0.62 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 67.57 |
cLogP: | 2.89358 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Order Status | |
Ordered: | 2020-04-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
WAR-XCH-72a8c209-11
0.722
WAR-XCH-72a8c209-10
0.712
WAR-XCH-72a8c209-14
0.605
MAK-UNK-bae89c02-2
0.583
MAK-UNK-6ca90168-9
0.459
MAK-UNK-10dfa458-38
0.396
SAD-SAT-f2e2579e-4
0.366
WAR-XCH-bdd24732-32
0.363
MAR-TRE-6a44bbf2-7
0.361
AAR-POS-d2a4d1df-37
0.361
MAK-UNK-6ca90168-6
0.354
VIK-SYN-9a3d118a-8
0.353
MAK-UNK-6ca90168-8
0.341
MAK-UNK-10dfa458-40
0.337
MAK-UNK-6ca90168-7
0.337
MAK-UNK-10dfa458-39
0.333
MAK-UNK-6c8f5f75-1
0.333
WAR-XCH-bdd24732-27
0.330
SAD-SAT-89668ff1-3
0.330
AAR-POS-0daf6b7e-6
0.321
MAR-TRE-6a44bbf2-15
0.321
AAR-POS-0daf6b7e-5
0.321
SEL-UNI-cd366922-5
0.318
LON-WEI-120e5cf5-15
0.317
MAR-TRE-6a44bbf2-86
0.317
GIA-UNK-20b63697-6
0.314
LON-WEI-120e5cf5-5
0.313
DRR-IMP-38dce17f-7
0.312
MAK-UNK-6ca90168-14
0.312
MAK-UNK-987948f6-3
0.312
MAK-UNK-6ca90168-11
0.312
MAK-UNK-af83ef51-2
0.310
BEN-DND-76ad4ac9-4
0.310
SAD-SAT-d8079f6f-4
0.309
SAD-SAT-f2e2579e-10
0.309
NIR-THE-0d6461ce-6
0.309
MAK-UNK-6ca90168-5
0.306
NIR-THE-0d6461ce-12
0.305
MAR-TRE-6a44bbf2-92
0.305
DUN-NEW-f8ce3686-25
0.304
WAR-XCH-72a8c209-5
0.304
DAV-CRI-d1e0885a-1
0.302
MAT-POS-ee51dedd-1
0.302
MED-COV-4280ac29-24
0.301
NIR-THE-0d6461ce-11
0.301
MAK-UNK-6ca90168-10
0.300
GIA-UNK-20b63697-8
0.300
MAR-TRE-6a44bbf2-9
0.299
MAK-UNK-6ca90168-22
0.299
DRR-IMP-dff87f5e-9
0.298
MAT-POS-162a9720-5
0.296
MAK-UNK-69bf97dd-7
0.296
MAK-UNK-6ca90168-18
0.296
SEL-UNI-cd366922-6
0.295
NIR-THE-0d6461ce-7
0.295
MAK-UNK-750cfbcc-3
0.293
MAR-TRE-6a44bbf2-79
0.293
MAK-UNK-7c9d1431-25
0.292
MAR-TRE-6a44bbf2-53
0.292
MAK-UNK-e4a48a85-26
0.292
NIR-THE-0d6461ce-10
0.292
MAK-UNK-af83ef51-6
0.291
MAK-UNK-212f693e-32
0.289
MAK-UNK-7c9d1431-20
0.289
GIA-UNK-20b63697-2
0.289
GIA-UNK-20b63697-3
0.289
GIA-UNK-20b63697-4
0.289
GIA-UNK-20b63697-5
0.289
MAR-TRE-1c920f6f-10
0.289
MAK-UNK-69bf97dd-8
0.289
SAD-SAT-89668ff1-9
0.287
MED-COV-4280ac29-4
0.287
SAD-SAT-29425be4-22
0.287
AAR-POS-0daf6b7e-9
0.286
VIR-GIT-7b3d3065-2
0.286
MAK-UNK-750cfbcc-5
0.286
DAR-DIA-fb20be43-6
0.284
MAK-UNK-c97f7c8f-1
0.284
LON-WEI-120e5cf5-16
0.284
SAD-SAT-edc8a235-7
0.284
MAK-UNK-3d7e3904-3
0.283
MAK-UNK-987948f6-15
0.282
AAR-POS-d2a4d1df-28
0.282
MAK-UNK-987948f6-2
0.282
MAK-UNK-849bee6c-9
0.281
LON-WEI-120e5cf5-11
0.281
MAK-UNK-e4a48a85-14
0.280
MAK-UNK-849bee6c-4
0.280
PAU-WEI-b9b69149-4
0.280
DAV-CRI-d1e0885a-4
0.280
MIH-UNI-e573136b-7
0.280
DAR-DIA-3e9bbd81-11
0.280
YOI-UNK-a533afbc-6
0.280
YOI-UNK-12211982-6
0.280
TAT-ENA-80bfd3e5-10
0.280
MIH-UNI-e573136b-5
0.278
MAK-UNK-750cfbcc-1
0.278
TAM-UNI-d1c3dd9f-17
0.277
MED-COV-4280ac29-35
0.277
MAK-UNK-3f402c2b-13
0.277