Molecular Properties | |
SMILES: | O=C(CCl)N1CC2CC1CN2Cc1cc(O)ccc1O |
MW: | 296.09 |
Fraction sp3: | 0.5 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 64.01 |
cLogP: | 1.12 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
para_hydroquinone
hydroquinone
o-Substituted phenols (2)
dihydroxybenzene
mannich_A(296)
MED-COV-4280ac29-15
MAK-UNK-df1a028e-6
0.522
MAK-UNK-3f402c2b-22
0.515
MAK-UNK-df1a028e-8
0.507
MAK-UNK-3f402c2b-26
0.507
SAD-SAT-581007d4-9
0.507
MAK-UNK-bae89c02-4
0.507
MAK-UNK-ec98eaf6-17
0.500
MAK-UNK-3f402c2b-14
0.500
DAN-LON-a5fc619e-8
0.500
MAK-UNK-3f402c2b-3
0.493
MAK-UNK-bae89c02-3
0.487
DAR-DIA-3e9bbd81-1
0.487
MAK-UNK-3f402c2b-16
0.486
NEH-REV-107bcf72-4
0.479
MAK-UNK-3f402c2b-21
0.479
MAK-UNK-5d2caa6f-6
0.475
DAR-DIA-3e9bbd81-4
0.470
DAR-DIA-3e9bbd81-10
0.470
MAK-UNK-ec98eaf6-24
0.469
MAK-UNK-10799360-22
0.469
MAK-UNK-10799360-4
0.465
MAK-UNK-ec98eaf6-21
0.463
DAR-DIA-3e9bbd81-2
0.463
MAK-UNK-ec98eaf6-23
0.463
MAK-UNK-ec98eaf6-16
0.457
MAK-UNK-ec98eaf6-22
0.457
MAK-UNK-ec98eaf6-14
0.455
SAD-SAT-581007d4-10
0.455
NEH-REV-107bcf72-5
0.449
DAR-DIA-3e9bbd81-8
0.448
DAR-DIA-3e9bbd81-9
0.448
MAK-UNK-10799360-12
0.444
MAK-UNK-10799360-6
0.442
MAK-UNK-10799360-16
0.440
MAK-UNK-5d2caa6f-7
0.439
MAK-UNK-10799360-21
0.435
MAK-UNK-ec98eaf6-25
0.426
MAK-UNK-10799360-20
0.425
MAK-UNK-10799360-10
0.424
MAK-UNK-ec98eaf6-47
0.422
MAK-UNK-5d2caa6f-23
0.419
MAK-UNK-10799360-19
0.416
MAK-UNK-ec98eaf6-28
0.409
MAK-UNK-3e0761f8-10
0.408
MAK-UNK-ec98eaf6-57
0.407
MAK-UNK-10799360-17
0.407
MAK-UNK-10799360-29
0.407
MAK-UNK-10799360-8
0.406
MAK-UNK-ec98eaf6-7
0.402
MAK-UNK-10799360-23
0.400
MAK-UNK-ec98eaf6-11
0.400
MAK-UNK-ec98eaf6-2
0.395
MAK-UNK-ec98eaf6-10
0.395
MAK-UNK-90d0606b-1
0.393
AVI-UNI-70b60925-2
0.388
MAK-UNK-3f402c2b-29
0.387
MAK-UNK-ec98eaf6-20
0.386
MAK-UNK-3f402c2b-7
0.370
MAK-UNK-ec98eaf6-19
0.368
MAK-UNK-3f402c2b-25
0.365
MAK-UNK-ec98eaf6-4
0.362
NEH-REV-107bcf72-1
0.360
MAK-UNK-10799360-32
0.360
MAK-UNK-3f402c2b-27
0.360
MAK-UNK-10799360-30
0.358
MAK-UNK-10799360-26
0.354
AVI-UNI-c9bf710f-2
0.353
MAK-UNK-90d0606b-7
0.353
MAK-UNK-3f402c2b-4
0.351
MAK-UNK-5d2caa6f-12
0.346
MAK-UNK-df1a028e-9
0.342
MAK-UNK-3f402c2b-1
0.342
MAK-UNK-3f402c2b-15
0.338
PEI-IMP-e4a008a2-1
0.338
MAK-UNK-ec98eaf6-13
0.333
MAK-UNK-3f402c2b-5
0.333
MAK-UNK-10799360-36
0.333
MAK-UNK-3f402c2b-2
0.329
MAK-UNK-3f402c2b-12
0.329
SAD-SAT-3a925b8b-8
0.329
MAK-UNK-3f402c2b-9
0.329
MAK-UNK-10799360-5
0.326
MAK-UNK-ec98eaf6-3
0.326
MAK-UNK-3f402c2b-17
0.325
MAK-UNK-3f402c2b-6
0.325
MAK-UNK-3f402c2b-24
0.325
MAK-UNK-3f402c2b-13
0.318
MAK-UNK-3f402c2b-11
0.317
MAK-UNK-5d2caa6f-3
0.317
MAK-UNK-df1a028e-4
0.313
AHN-SAT-721e3e40-1
0.310
MAK-UNK-10799360-1
0.310
MAK-UNK-5d2caa6f-5
0.310
DAR-DIA-3e9bbd81-3
0.307
MAK-UNK-ec98eaf6-6
0.307
MAK-UNK-ec98eaf6-9
0.307
MAK-UNK-5d2caa6f-4
0.302
MAK-UNK-3f402c2b-19
0.301
MAK-UNK-90d0606b-3
0.299
MAK-UNK-ec98eaf6-1
0.297