Molecular Properties | |
SMILES: | CC(=O)c1ccc(Br)c2[nH]c(=O)n(-c3cccnc3)c12 |
MW: | 332.157 |
Fraction sp3: | 0.07 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 67.75 |
cLogP: | 2.6789 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Order Status | |
Ordered: | 2020-06-10 |
Synthesis Location: | wuxi |
Shipped: | synthesis in progress |
Filter9_metal
aryl bromide
Ketone
NIM-UNI-0ea3b7bf-1
0.701
NIM-UNI-36e12f95-5
0.632
NIM-UNI-36e12f95-4
0.577
NIM-UNI-0ea3b7bf-3
0.468
NIM-UNI-0ea3b7bf-2
0.448
NIM-UNI-7f77122c-1
0.369
NIM-UNI-0ea3b7bf-4
0.303
RAI-NOV-c18e0037-7
0.291
MAR-TRE-b77b7921-87
0.291
RAI-NOV-c18e0037-1
0.287
NIM-UNI-7f77122c-2
0.284
MAK-UNK-2c1752f0-2
0.284
NIM-UNI-36e12f95-1
0.279
RAI-NOV-c18e0037-4
0.277
NIM-UNI-0ea3b7bf-5
0.277
PET-UNK-4dc48bbe-3
0.273
EMI-TUK-b780fc43-1
0.267
EMI-TUK-6c6b371f-1
0.267
MAR-TRE-04c86cea-13
0.266
PET-UNK-94460c07-5
0.264
MAK-UNK-9e4a73aa-11
0.264
PET-UNK-94460c07-6
0.264
PET-UNK-4dc48bbe-5
0.259
DAR-DIA-fc970077-3
0.257
NIM-UNI-7f77122c-3
0.256
MAK-UNK-9e4a73aa-18
0.256
NIM-UNI-36e12f95-2
0.255
MAK-UNK-2c1752f0-3
0.254
NIM-UNI-534877e5-1
0.253
MAK-UNK-9e4a73aa-17
0.253
MAK-UNK-9e4a73aa-36
0.253
MAK-UNK-9e4a73aa-33
0.250
PET-UNK-4dc48bbe-9
0.250
DAR-DIA-fc970077-1
0.250
MAK-UNK-9e4a73aa-21
0.250
MAK-UNK-9e4a73aa-7
0.250
MAK-UNK-9e4a73aa-34
0.247
MAK-UNK-9e4a73aa-20
0.247
MAK-UNK-9e4a73aa-10
0.247
MAR-TRE-2fd8122f-93
0.245
RAI-NOV-c18e0037-3
0.245
PET-UNK-4dc48bbe-1
0.244
MAK-UNK-9e4a73aa-35
0.242
MAR-TRE-3e4e6814-100
0.242
MAK-UNK-9e4a73aa-19
0.242
MAK-UNK-9e4a73aa-26
0.242
MAK-UNK-9e4a73aa-22
0.242
MAK-UNK-9e4a73aa-27
0.242
MAK-UNK-9e4a73aa-25
0.242
MAK-UNK-9e4a73aa-23
0.242
RAI-NOV-c18e0037-2
0.242
MAK-UNK-9e4a73aa-24
0.242
DAR-DIA-fc970077-6
0.241
DAR-DIA-fc970077-10
0.241
MAK-UNK-ca11b4f7-2
0.239
MAK-UNK-ca11b4f7-3
0.239
JAN-GHE-d851b096-5
0.239
KEI-TRE-d5e2018a-74
0.239
MAK-UNK-9e4a73aa-12
0.239
PET-UNK-4dc48bbe-7
0.239
EMI-TUK-b780fc43-2
0.237
DAR-DIA-fc970077-9
0.237
DAR-DIA-842b4336-3
0.237
KEI-TRE-d5e2018a-15
0.237
MAR-TRE-7f7bb9f0-18
0.237
MAK-UNK-9e4a73aa-8
0.237
MAK-UNK-9e4a73aa-32
0.235
MAR-TRE-2fd8122f-73
0.235
KEI-TRE-d5e2018a-68
0.234
TAT-ENA-80bfd3e5-49
0.234
DAR-DIA-fc970077-7
0.233
MAR-TRE-fd17a9b8-69
0.232
NIM-UNI-534877e5-2
0.232
MAR-TRE-74c6519b-18
0.232
MAR-TRE-74c6519b-26
0.232
DAR-DIA-fc970077-5
0.232
PET-UNK-7a31b064-6
0.232
MAR-TRE-3e4e6814-93
0.230
KEI-TRE-d5e2018a-10
0.229
MED-UNK-e6e8ef8a-7
0.229
MAK-UNK-9e4a73aa-9
0.228
SAD-SAT-24589cd1-4
0.228
STE-UNK-28609fce-1
0.228
CAS-DEP-167c18e3-4
0.227
MAR-TRE-9c797165-66
0.226
MAR-TRE-2fd8122f-27
0.225
KEI-TRE-d5e2018a-23
0.224
MAR-TRE-4b834d9a-27
0.224
NIM-UNI-534877e5-3
0.224
MAR-TRE-2fd8122f-76
0.223
JAC-SHE-fc18d444-1
0.223
KEI-TRE-d5e2018a-97
0.222
ANT-DIA-3c79be55-5
0.222
MAR-TRE-2fd8122f-84
0.222
DRR-IMP-38dce17f-4
0.222
JAN-GHE-83b26c96-18
0.221
DAR-DIA-fc970077-12
0.221
DAR-DIA-fc970077-11
0.221
MAR-TRE-fd17a9b8-39
0.220
MAR-TRE-2fd8122f-5
0.220