Molecular Properties | |
SMILES: | CCOc1ccccc1OC1CCN(C(=O)c2c(C)c(=O)[nH]c3ccccc23)C1 |
MW: | 392.17 |
Fraction sp3: | 0.3 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 71.63 |
cLogP: | 3.53 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z3607510615 |
Enamine Extended REAL: | s_22____14587402____13422052 |
MolPort: | MolPort-047-561-513 |
Order Status | |
Ordered: | 2020-05-17 |
Synthesis Location: | enamine |
Shipped: | 2020-07-21 |
AAR-POS-d2a4d1df-1
MAT-POS-590ac91e-44
0.648
MAT-POS-590ac91e-48
0.510
MAT-POS-590ac91e-49
0.490
ERI-UCB-a0b0dbcb-6
0.490
ERI-UCB-a0b0dbcb-5
0.351
ERI-UCB-a0b0dbcb-9
0.346
MEL-NAT-8c3652c8-2
0.330
MAT-POS-590ac91e-54
0.328
ERI-UCB-a0b0dbcb-8
0.306
ERI-UCB-ce40166b-25
0.306
DAR-DIA-8e329c92-4
0.283
LON-WEI-4d77710c-3
0.276
LON-WEI-5e7d1b3e-3
0.276
DAR-DIA-8e329c92-5
0.274
BEN-DND-7e92b6ca-13
0.273
MAT-POS-54c4bf04-4
0.270
ERI-UCB-a0b0dbcb-7
0.269
MAT-UCB-70f7c0f7-4
0.268
DAR-DIA-8e329c92-7
0.264
DAR-DIA-8e329c92-8
0.264
DAR-DIA-8e329c92-6
0.263
KRI-MAR-d2e3ef86-7
0.259
MAT-UCB-70f7c0f7-3
0.256
ADA-UCB-b1b30a00-2
0.256
ERI-UCB-a0b0dbcb-11
0.256
MAR-TRE-fd17a9b8-5
0.254
KRI-MAR-d2e3ef86-6
0.252
NAU-LAT-56d5284e-3
0.250
BEN-DND-7e92b6ca-2
0.250
MAT-POS-916a2c5a-2
0.250
MAR-UCB-f313ec4d-1
0.250
BEN-DND-7e92b6ca-14
0.250
ERI-UCB-ce40166b-21
0.248
NAU-LAT-56d5284e-2
0.248
BEN-DND-7e92b6ca-10
0.248
KRI-MAR-d2e3ef86-5
0.248
ALP-POS-3fc1724e-3
0.246
MAR-TRE-fd17a9b8-9
0.243
MAT-POS-916a2c5a-3
0.243
KRI-MAR-d2e3ef86-4
0.243
MAR-TRE-fd17a9b8-67
0.243
BEN-VAN-d8fd1356-28
0.243
ALP-POS-3fc1724e-4
0.242
ADA-UCB-6c2cb422-8
0.242
MAR-UCB-195bc32d-12
0.240
BEN-DND-7e92b6ca-11
0.239
KRI-MAR-d2e3ef86-13
0.239
BEN-DND-7e92b6ca-6
0.238
EDJ-MED-d1cd9639-1
0.237
ERI-UCB-a0b0dbcb-10
0.237
KRI-MAR-d2e3ef86-15
0.237
MAR-TRE-fd17a9b8-55
0.237
MAR-UCB-f313ec4d-4
0.237
MAR-TRE-66ac689e-91
0.236
MAR-TRE-f5c2d31c-69
0.236
ERI-UCB-d6de1f3c-8
0.235
ERI-UCB-a0b0dbcb-13
0.235
JON-UNI-bb9dc649-8
0.235
MAR-UCB-f313ec4d-5
0.235
BEN-DND-7e92b6ca-12
0.235
MAK-UNK-df1a028e-2
0.233
ERI-UCB-a0b0dbcb-4
0.233
ERI-UCB-a0b0dbcb-12
0.233
NAU-LAT-56d5284e-8
0.233
ALP-POS-d9b6304e-1
0.232
ALP-POS-a2344586-2
0.232
EDJ-MED-78f964c8-1
0.231
MAT-POS-916a2c5a-4
0.231
ERI-UCB-a0b0dbcb-14
0.231
MAR-TRE-fd17a9b8-20
0.231
MAK-UNK-df1a028e-3
0.230
ERI-UCB-a0b0dbcb-2
0.230
MAT-POS-162a9720-8
0.230
MAT-POS-3b92565d-6
0.230
BEN-VAN-d8fd1356-25
0.229
RED-RED-10c9212c-14
0.229
MAR-TRE-0fda4e82-3
0.229
MAR-TRE-4b834d9a-27
0.228
AAR-POS-fca48359-3
0.228
DAV-UNI-bdcebb58-1
0.228
BEN-DND-7e92b6ca-15
0.228
KEI-TRE-d5e2018a-23
0.228
DAR-DIA-eace69ff-2
0.228
MAR-TRE-c8530538-68
0.227
BEN-DND-7e92b6ca-9
0.226
AAR-UNI-c25c2f1e-66
0.226
BEN-DND-7e92b6ca-16
0.225
MED-COV-4280ac29-17
0.225
JAN-GHE-82a280f8-3
0.225
MAR-TRE-a3327163-3
0.224
MAT-POS-54c4bf04-1
0.224
LON-WEI-120e5cf5-9
0.224
ERI-UCB-a0b0dbcb-3
0.224
ALP-POS-fc6c627f-3
0.224
MAK-UNK-a7992eb3-7
0.223
ADA-UCB-b1b30a00-1
0.222
BEN-DND-7e92b6ca-7
0.221
BEN-VAN-d8fd1356-27
0.221
MAK-UNK-ec98eaf6-5
0.220
MAR-UCB-d1255a91-1
0.220