Molecular Properties | |
SMILES: | O=C(Nc1cccc(CN2CCN(C(=O)CCl)CC2)c1)c1cnc(Cc2ccccc2)s1 |
MW: | 469.01 |
Fraction sp3: | 0.29 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 65.54 |
cLogP: | 3.8692 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-04-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
AAR-POS-d2a4d1df-1
MAK-UNK-e4a48a85-8
0.787
MAK-UNK-10799360-32
0.639
MED-COV-4280ac29-25
0.534
MED-COV-4280ac29-8
0.500
MAK-UNK-849bee6c-4
0.474
DRR-IMP-38dce17f-3
0.438
MAK-UNK-7c9d1431-24
0.438
AAR-POS-d2a4d1df-24
0.435
JOH-UNI-0e1753c1-3
0.424
MED-COV-4280ac29-15
0.424
AAR-POS-d2a4d1df-35
0.424
HYO-UNK-49a60884-1
0.424
MAK-UNK-849bee6c-3
0.423
MAK-UNK-176ca439-3
0.423
MAK-UNK-cd94b63c-1
0.423
MED-COV-4280ac29-19
0.418
DRR-IMP-38dce17f-2
0.414
MAK-UNK-849bee6c-7
0.412
MAK-UNK-849bee6c-9
0.408
JOK-SYG-18591e8f-1
0.400
MAK-UNK-849bee6c-14
0.396
MAT-POS-ee51dedd-1
0.396
MAK-UNK-af83ef51-1
0.387
MAK-UNK-849bee6c-5
0.385
MAK-UNK-e4a48a85-21
0.380
DRR-IMP-38dce17f-6
0.376
STE-KUL-2e0d2e88-7
0.375
MAK-UNK-849bee6c-12
0.375
MAK-UNK-849bee6c-16
0.375
DRR-IMP-38dce17f-4
0.375
MAK-UNK-176ca439-2
0.371
MAK-UNK-849bee6c-6
0.371
MAK-UNK-849bee6c-13
0.370
MAK-UNK-e4a48a85-20
0.370
MAR-TRE-6a44bbf2-3
0.365
TAM-UNI-d1c3dd9f-12
0.363
SAD-SAT-f0a2747f-4
0.356
MAK-UNK-3c359d2a-1
0.355
MAK-UNK-176ca439-4
0.355
MAK-UNK-849bee6c-15
0.355
MAK-UNK-ec98eaf6-11
0.352
MAK-UNK-7c9d1431-14
0.351
MAK-UNK-7c9d1431-29
0.349
MAK-UNK-849bee6c-8
0.349
DRR-IMP-38dce17f-5
0.348
MAK-UNK-af83ef51-20
0.348
MAK-UNK-009ebe36-8
0.346
MAK-UNK-849bee6c-17
0.345
MED-COV-dea4df70-1
0.343
MAK-UNK-e4a48a85-7
0.343
MAK-UNK-10dfa458-45
0.342
MAK-UNK-af83ef51-19
0.342
TAM-UNI-d1c3dd9f-5
0.340
TAM-UNI-d1c3dd9f-6
0.340
AAR-POS-0daf6b7e-13
0.337
LON-WEI-8f408cad-7
0.337
MAK-UNK-212f693e-8
0.337
MAK-UNK-15efde89-1
0.337
MAK-UNK-7c9d1431-16
0.337
MAR-TRE-6a44bbf2-54
0.337
SAD-SAT-5b1897b2-5
0.337
MAR-TRE-66ac689e-31
0.337
AAR-POS-d2a4d1df-40
0.333
MED-COV-4280ac29-31
0.333
MAK-UNK-e4a48a85-23
0.333
MAK-UNK-849bee6c-1
0.330
TAM-UNI-d1c3dd9f-19
0.330
PAU-UNI-19862c28-1
0.330
TAM-UNI-d1c3dd9f-16
0.330
DAR-DIA-fb20be43-8
0.330
SEL-UNI-cd366922-6
0.330
PAU-UNI-8cdd41c7-1
0.330
MAR-TRE-799db12b-40
0.327
MAK-UNK-987948f6-11
0.327
DAR-DIA-fb20be43-4
0.327
SEL-UNI-cd366922-7
0.327
BRU-LEF-ae0885ba-1
0.327
PAU-UNI-52c0427f-1
0.327
JAN-GHE-1d98ec1c-8
0.327
MAK-UNK-7c9d1431-20
0.326
MAK-UNK-af83ef51-21
0.325
FRA-BIO-8bf1eac9-4
0.325
MAR-TRE-66ac689e-34
0.324
DAR-DIA-fb20be43-1
0.324
DAN-LON-a5fc619e-10
0.324
MAK-UNK-7c9d1431-18
0.323
PAU-UNI-b2b6b158-1
0.323
DRR-IMP-38dce17f-1
0.322
AHN-SAT-de2502ba-7
0.322
MAK-UNK-849bee6c-26
0.322
SAD-SAT-29425be4-8
0.321
MAK-UNK-e4a48a85-18
0.321
JOO-PER-58e158bd-1
0.320
DAR-DIA-fb20be43-5
0.320
DAR-DIA-fb20be43-2
0.320
SAD-SAT-581007d4-4
0.320
AAR-POS-0daf6b7e-17
0.319
DRR-IMP-38dce17f-7
0.319
LON-WEI-8f408cad-5
0.319
AAR-POS-0daf6b7e-2
0.319