Molecular Properties | |
SMILES: | COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2cccc(OCCOCCOC3=CC=CC4C(=O)N(C5CCC(=O)NC5=O)C(=O)C34)c12 |
MW: | 700.24 |
Fraction sp3: | 0.33 |
HBA: | 11 |
HBD: | 3 |
Rotatable Bonds: | 15 |
TPSA: | 191.66 |
cLogP: | 1.62 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Aliphatic long chain
phthalimide
Glutarimides
Filter78_bicyclic_Imide
poly ethers
acyclic C=C-O
cycloheximide
Long aliphatic chain
Unbranched chain
DAR-DIA-9e4459de-18
0.778
DAR-DIA-9e4459de-23
0.757
DAR-DIA-9e4459de-21
0.752
DAR-DIA-9e4459de-19
0.694
DAR-DIA-9e4459de-24
0.673
DAR-DIA-9e4459de-17
0.658
DAR-DIA-9e4459de-20
0.591
EDJ-MED-6af13d92-3
0.500
EDJ-MED-bbe8e3da-2
0.466
EDJ-MED-6af13d92-2
0.443
EDJ-MED-6af13d92-1
0.443
EDJ-MED-bbe8e3da-4
0.423
EDJ-MED-bbe8e3da-1
0.415
MAT-POS-3b536971-1
0.404
EDJ-MED-edeb0d3a-2
0.404
EDJ-MED-bbe8e3da-3
0.401
DAR-DIA-9e4459de-7
0.391
VLA-UNK-eaa804fd-3
0.387
MAT-POS-916a2c5a-2
0.381
MAT-POS-590ac91e-32
0.370
MAT-POS-590ac91e-42
0.367
MAT-POS-35d3f55a-2
0.365
DAR-DIA-9e4459de-6
0.351
DAR-DIA-9e4459de-10
0.343
DAR-DIA-9e4459de-9
0.343
DAR-DIA-9e4459de-8
0.320
DAR-DIA-9e4459de-2
0.318
DAR-DIA-8e329c92-2
0.314
JOH-UNI-abfda500-3
0.314
BEN-DND-7e92b6ca-1
0.308
ALP-POS-05819dc4-1
0.308
DAR-DIA-9e4459de-11
0.307
DAR-DIA-8e329c92-3
0.307
ERI-UCB-ce40166b-14
0.303
ERI-UCB-ce40166b-25
0.301
ALP-POS-3fc1724e-1
0.299
MAT-POS-8fd29122-1
0.299
ALP-POS-fc6c627f-3
0.294
MAT-UCB-70f7c0f7-1
0.289
MAT-POS-91829f0d-1
0.289
MAR-UCB-f313ec4d-2
0.289
ERI-UCB-ce40166b-13
0.288
ERI-UCB-ce40166b-18
0.287
DAR-DIA-9e4459de-13
0.286
MAT-POS-590ac91e-47
0.285
MAT-POS-590ac91e-46
0.285
DAR-DIA-8e329c92-1
0.285
DAR-DIA-9e4459de-1
0.283
MAT-POS-590ac91e-53
0.283
MAT-POS-35d3f55a-1
0.283
PET-UNK-752bebd6-1
0.281
DAR-DIA-8e329c92-5
0.276
ALP-POS-bea7b391-2
0.276
DAR-DIA-8e329c92-4
0.275
DAR-DIA-1a77c53a-19
0.273
DAR-DIA-9e4459de-4
0.273
DAR-DIA-9e4459de-5
0.272
MAT-UCB-70f7c0f7-2
0.272
DAR-DIA-1a77c53a-20
0.272
EDJ-MED-edeb0d3a-3
0.272
ALP-POS-bea7b391-3
0.269
DAR-DIA-8e329c92-7
0.269
DAR-DIA-8e329c92-8
0.269
MAT-POS-3b536971-2
0.268
DAR-DIA-8e329c92-6
0.268
ALP-POS-3fc1724e-2
0.268
DAR-DIA-1a77c53a-9
0.268
ERI-UCB-ce40166b-17
0.268
BEN-DND-7e92b6ca-2
0.267
DAR-DIA-1a77c53a-17
0.267
DAR-DIA-1a77c53a-18
0.264
DAR-DIA-1a77c53a-10
0.264
DAR-DIA-1a77c53a-11
0.264
ERI-UCB-ce40166b-15
0.263
MAT-POS-590ac91e-37
0.260
DAR-DIA-1a77c53a-5
0.259
DAR-DIA-1a77c53a-6
0.259
ERI-UCB-a0b0dbcb-9
0.259
MAR-UCB-f313ec4d-1
0.259
MAT-POS-590ac91e-43
0.258
DAR-DIA-1a77c53a-2
0.258
DAR-DIA-1a77c53a-24
0.258
NAU-LAT-a5c7d7cb-7
0.257
EDJ-MED-d1cd9639-2
0.257
MAT-UCB-70f7c0f7-4
0.255
DAR-DIA-1a77c53a-1
0.255
DAR-DIA-1a77c53a-14
0.255
BEN-DND-7e92b6ca-5
0.254
DAR-DIA-1a77c53a-7
0.253
DAR-DIA-1a77c53a-23
0.253
DAR-DIA-1a77c53a-13
0.253
DAR-DIA-1a77c53a-12
0.253
DAR-DIA-9e4459de-3
0.251
DAR-DIA-1a77c53a-3
0.250
DAR-DIA-1a77c53a-8
0.250
DAR-DIA-1a77c53a-4
0.250
DAR-DIA-9e4459de-15
0.249
ERI-UCB-ce40166b-19
0.248
MAT-POS-590ac91e-41
0.248
MAT-POS-590ac91e-40
0.248