Molecular Properties | |
SMILES: | COC1=CC(=O)C=C(COc2csc(CCl)n2)C1=O |
MW: | 299.0 |
Fraction sp3: | 0.25 |
HBA: | 6 |
HBD: | 0 |
Rotatable Bonds: | 5 |
TPSA: | 65.49 |
cLogP: | 1.87 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
chinone
p-Quinones
Activated double bonds (2)
Quinones, quinone-(di)imines and their thio- and phospho-analogues
N1 Quinones
Filter6_benzyl_halide
quinones
acyclic C=C-O
Ketone
vinyl michael acceptor1
quinone
quinone_A(370)
Alkyl Halide
MAR-TRE-36bf7dba-2
0.397
MAR-TRE-36bf7dba-6
0.368
MAR-TRE-36bf7dba-5
0.366
MAR-TRE-36bf7dba-81
0.366
MAR-TRE-36bf7dba-83
0.364
MAR-TRE-36bf7dba-7
0.362
MAR-TRE-36bf7dba-3
0.361
MAR-TRE-36bf7dba-11
0.358
MAR-TRE-36bf7dba-70
0.352
MAR-TRE-36bf7dba-80
0.347
MAR-TRE-36bf7dba-10
0.346
MAR-TRE-36bf7dba-20
0.342
MAR-TRE-36bf7dba-19
0.342
MAR-TRE-36bf7dba-86
0.338
MAR-TRE-36bf7dba-8
0.338
MAR-TRE-36bf7dba-12
0.338
MAR-TRE-36bf7dba-38
0.333
MAR-TRE-36bf7dba-85
0.329
MAR-TRE-36bf7dba-39
0.329
MAR-TRE-36bf7dba-25
0.329
MAR-TRE-36bf7dba-96
0.325
MAR-TRE-36bf7dba-60
0.325
MAR-TRE-36bf7dba-100
0.325
MAR-TRE-36bf7dba-45
0.321
MAR-TRE-36bf7dba-94
0.321
MAR-TRE-36bf7dba-33
0.320
MAR-TRE-36bf7dba-50
0.316
MAR-TRE-36bf7dba-37
0.312
MAR-TRE-36bf7dba-36
0.312
MAR-TRE-36bf7dba-90
0.311
MAR-TRE-36bf7dba-46
0.310
MAR-TRE-36bf7dba-15
0.305
MAR-TRE-36bf7dba-23
0.303
MAR-TRE-36bf7dba-89
0.299
MAR-TRE-36bf7dba-44
0.298
MAR-TRE-36bf7dba-95
0.296
MAR-TRE-36bf7dba-51
0.295
MAR-TRE-36bf7dba-48
0.293
MAR-TRE-36bf7dba-43
0.293
MAR-TRE-36bf7dba-61
0.292
MAR-TRE-36bf7dba-67
0.291
MAR-TRE-36bf7dba-77
0.289
MAR-TRE-36bf7dba-28
0.287
MAR-TRE-36bf7dba-30
0.287
MAR-TRE-36bf7dba-24
0.287
MAR-TRE-36bf7dba-47
0.286
MAR-TRE-36bf7dba-14
0.284
MAR-TRE-36bf7dba-49
0.284
MAR-TRE-36bf7dba-54
0.282
MAR-TRE-36bf7dba-53
0.282
MAR-TRE-36bf7dba-4
0.282
MAR-TRE-36bf7dba-32
0.279
MAR-TRE-36bf7dba-56
0.277
MAR-TRE-36bf7dba-98
0.277
MAR-TRE-36bf7dba-91
0.276
MAR-TRE-36bf7dba-99
0.276
MAR-TRE-36bf7dba-52
0.276
MAR-TRE-36bf7dba-41
0.275
MAR-TRE-36bf7dba-1
0.275
MAR-TRE-36bf7dba-87
0.275
MAR-TRE-36bf7dba-55
0.274
MAR-TRE-36bf7dba-9
0.273
MAR-TRE-36bf7dba-13
0.273
MAR-TRE-36bf7dba-97
0.273
MAR-TRE-36bf7dba-16
0.273
MAR-TRE-36bf7dba-69
0.273
MAR-TRE-36bf7dba-79
0.273
MAR-TRE-36bf7dba-76
0.271
MAR-TRE-36bf7dba-59
0.268
MAR-TRE-36bf7dba-18
0.268
MAR-TRE-36bf7dba-35
0.267
MAR-TRE-36bf7dba-92
0.267
MAR-TRE-36bf7dba-62
0.266
MAR-TRE-36bf7dba-31
0.266
MAR-TRE-36bf7dba-40
0.265
MAR-TRE-36bf7dba-17
0.263
MAR-TRE-36bf7dba-57
0.262
MAR-TRE-36bf7dba-74
0.262
MAR-TRE-36bf7dba-64
0.262
MAR-TRE-36bf7dba-34
0.259
MAR-TRE-36bf7dba-29
0.259
MAR-TRE-36bf7dba-22
0.256
MAR-TRE-36bf7dba-68
0.256
MAR-TRE-36bf7dba-71
0.253
MAR-TRE-36bf7dba-66
0.253
MAR-TRE-36bf7dba-58
0.250
MAR-TRE-36bf7dba-63
0.247
MAR-TRE-36bf7dba-93
0.247
MAR-TRE-36bf7dba-84
0.244
MAR-TRE-36bf7dba-42
0.242
MAR-TRE-36bf7dba-88
0.239
MAR-TRE-36bf7dba-75
0.237
MAR-TRE-36bf7dba-78
0.236
MAR-TRE-36bf7dba-26
0.235
MAR-TRE-36bf7dba-82
0.234
MAR-TRE-36bf7dba-65
0.233
MAR-TRE-36bf7dba-73
0.230
MAR-TRE-36bf7dba-27
0.229
MAR-TRE-36bf7dba-21
0.226
MAR-TRE-6c5ef77a-87
0.218