Molecular Properties | |
SMILES: | CN(CC(=O)C1CCCN1C(=O)c1ccccc1)C(=O)CCl |
MW: | 322.792 |
Fraction sp3: | 0.44 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 5 |
TPSA: | 57.69 |
cLogP: | 1.5575 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-04-17 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Ketones
aliphatic ketone not ring and not di-carbonyl
Ketone
AAR-POS-d2a4d1df-12
GIA-UNK-d2defdc3-7
0.580
GIA-UNK-d2defdc3-6
0.438
MAK-UNK-987948f6-2
0.329
GIA-UNK-5ec6c2b8-1
0.292
GIA-UNK-eaadd1d4-1
0.291
MAK-UNK-3e0761f8-8
0.289
SAD-SAT-d8079f6f-8
0.288
MAR-TRE-6a44bbf2-80
0.287
TAT-ENA-80bfd3e5-42
0.282
AAR-POS-0daf6b7e-5
0.282
MAT-POS-fa06b69f-8
0.282
GIA-UNK-595fac82-2
0.278
GIA-UNK-995df016-10
0.278
DAV-UNI-bdcebb58-1
0.277
AAR-POS-fca48359-3
0.277
SAD-SAT-d8079f6f-10
0.275
LON-WEI-120e5cf5-5
0.275
MAR-TRE-6a44bbf2-98
0.275
DAV-UNI-bdcebb58-4
0.271
FRA-BIO-8bf1eac9-13
0.268
DUN-NEW-f8ce3686-22
0.265
DAR-DIA-eace69ff-10
0.263
GIA-UNK-d2defdc3-8
0.262
DAR-DIA-eace69ff-20
0.261
SAD-SAT-d8079f6f-7
0.261
JOH-UNI-8a168a37-1
0.260
MAR-TRE-6a44bbf2-85
0.260
ZAC-WAB-0847d168-1
0.259
SIM-SYN-7db9eb24-1
0.258
TAT-ENA-80bfd3e5-23
0.253
STE-KUL-2e0d2e88-1
0.253
GIA-UNK-20b63697-5
0.253
MAK-UNK-10799360-2
0.253
DAR-DIA-eace69ff-6
0.252
DAR-DIA-eace69ff-11
0.252
SIM-SYN-7db9eb24-2
0.250
MAR-TRE-6a44bbf2-76
0.250
RAI-NOV-2f6a9876-4
0.250
MAR-TRE-74c6519b-24
0.250
DAR-DIA-eace69ff-2
0.248
SAL-INS-1c7a5a55-11
0.247
DUN-NEW-f8ce3686-3
0.247
MAK-UNK-3f402c2b-18
0.247
GIA-UNK-20b63697-6
0.247
MAK-UNK-3f402c2b-4
0.247
DRA-CSI-47e38074-2
0.247
SAL-INS-1c7a5a55-7
0.245
MAR-TRE-6a44bbf2-71
0.244
WAR-XCH-bdd24732-37
0.244
DRA-CSI-47e38074-13
0.244
MAK-UNK-987948f6-1
0.243
COM-UCB-1ef4e90e-11
0.243
MAR-TRE-fd17a9b8-5
0.242
DUN-NEW-f8ce3686-25
0.242
MAK-UNK-df1a028e-7
0.241
MAK-UNK-af83ef51-2
0.241
DRA-CSI-47e38074-3
0.241
MAR-LAB-efb042c5-6
0.241
MAK-UNK-6ca90168-11
0.241
MAK-UNK-f983951f-12
0.240
MAR-LAB-efb042c5-2
0.240
MAR-TRE-87acfbcc-18
0.240
RED-RED-10c9212c-36
0.240
SAD-SAT-c989feaa-10
0.239
DAN-MCD-1c3944e2-1
0.238
AAR-POS-0daf6b7e-1
0.237
STE-KUL-2e0d2e88-4
0.237
GIA-UNK-20b63697-8
0.236
DRA-CSI-47e38074-10
0.235
SAD-SAT-29425be4-16
0.235
GIA-UNK-c4371e97-2
0.235
MAK-UNK-3e0761f8-9
0.234
SAD-SAT-29425be4-23
0.234
TAT-ENA-80bfd3e5-11
0.234
SEL-UNI-cd366922-1
0.233
AAR-UNI-c25c2f1e-103
0.233
DRA-CSI-7ec17797-3
0.233
DRA-CSI-47e38074-14
0.233
MAR-TRE-6a44bbf2-9
0.233
SAL-INS-1c7a5a55-1
0.232
SAD-SAT-d8079f6f-9
0.232
LON-WEI-120e5cf5-15
0.232
MAR-TRE-6a44bbf2-86
0.232
MAR-TRE-6a44bbf2-94
0.232
YOI-UNK-a533afbc-6
0.231
MAK-UNK-6435e6c2-9
0.231
AAR-POS-0daf6b7e-26
0.231
MAR-TRE-3e4e6814-96
0.231
YOI-UNK-12211982-6
0.231
MAR-TRE-fd17a9b8-9
0.230
MAR-TRE-9c797165-84
0.230
LON-WEI-ff7b210a-9
0.229
MAK-UNK-3f402c2b-25
0.229
MAK-UNK-7c9d1431-27
0.229
BAR-COM-4e090d3a-59
0.229
SER-UNI-400afb01-4
0.229
MED-COV-4280ac29-25
0.228
MAK-UNK-5d2caa6f-4
0.228
TIM-UNK-6bd61028-1
0.228
MAR-TRE-6a44bbf2-99
0.228