Molecular Properties | |
SMILES: | O=C(c1cc(=O)[nH]c2ccccc12)N1CCCC(c2cccc(Cl)c2)C1=O |
MW: | 380.09 |
Fraction sp3: | 0.19 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 70.24 |
cLogP: | 3.73 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
phthalimide
ERI-UCB-a0b0dbcb-2
VLA-UCB-eb340134-1
0.821
NAU-LAT-56d5284e-2
0.605
NAU-LAT-56d5284e-3
0.527
JAN-GHE-82a280f8-1
0.516
VLA-UCB-eb340134-2
0.516
VLA-UCB-eb340134-4
0.511
ERI-UCB-a0b0dbcb-12
0.505
ERI-UCB-a0b0dbcb-2
0.495
ERI-UCB-d6de1f3c-1
0.489
ERI-UCB-d6de1f3c-8
0.485
NAU-LAT-56d5284e-8
0.474
MAR-UCB-d1255a91-2
0.461
MAT-POS-54c4bf04-4
0.459
NAU-LAT-56d5284e-5
0.453
MAR-UCB-d1255a91-1
0.448
NAU-LAT-56d5284e-1
0.442
JAN-GHE-82a280f8-2
0.440
ERI-UCB-d6de1f3c-3
0.436
ERI-UCB-d6de1f3c-4
0.432
BEN-DND-7e92b6ca-10
0.430
KRI-MAR-d2e3ef86-5
0.430
EDJ-MED-d1cd9639-1
0.430
BEN-DND-7e92b6ca-6
0.427
NAU-LAT-56d5284e-4
0.424
MAT-POS-916a2c5a-4
0.413
EDJ-MED-78f964c8-1
0.413
JAN-GHE-82a280f8-3
0.412
NAU-LAT-56d5284e-7
0.408
DAR-DIA-53551c05-17
0.408
BEN-DND-7e92b6ca-14
0.404
MAR-UCB-f313ec4d-5
0.404
ERI-UCB-a0b0dbcb-3
0.404
BEN-DND-7e92b6ca-12
0.404
ERI-UCB-a0b0dbcb-6
0.402
BEN-DND-7e92b6ca-16
0.400
BEN-DND-7e92b6ca-13
0.398
BEN-DND-7e92b6ca-15
0.398
ERI-UCB-a0b0dbcb-9
0.398
ERI-UCB-a0b0dbcb-14
0.396
KRI-MAR-d2e3ef86-6
0.396
NAU-LAT-56d5284e-6
0.396
KRI-MAR-d2e3ef86-7
0.394
BEN-DND-7e92b6ca-7
0.392
ALP-POS-3fc1724e-3
0.390
PET-UNK-c9c1e0d8-3
0.390
ERI-UCB-a0b0dbcb-4
0.386
PET-UNK-fcd64629-1
0.385
ALP-POS-3fc1724e-4
0.385
ERI-UCB-a0b0dbcb-13
0.385
ERI-UCB-a0b0dbcb-11
0.385
KRI-MAR-d2e3ef86-13
0.384
BEN-DND-7e92b6ca-11
0.384
ERI-UCB-ce40166b-21
0.383
ALP-POS-bea7b391-1
0.381
BEN-DND-7e92b6ca-9
0.380
ERI-UCB-a0b0dbcb-1
0.375
MAK-UNK-df1a028e-3
0.374
MAT-POS-916a2c5a-3
0.373
KRI-MAR-d2e3ef86-4
0.373
DAR-DIA-53551c05-22
0.368
NAU-LAT-a5c7d7cb-7
0.366
ERI-UCB-a0b0dbcb-10
0.362
ERI-UCB-a0b0dbcb-5
0.361
DAR-DIA-53551c05-20
0.360
PET-UNK-7b413b46-1
0.359
VLA-UCB-1dbca3b4-10
0.359
PET-UNK-689df078-1
0.359
PET-UNK-7b413b46-5
0.359
ADA-UCB-b1b30a00-2
0.358
ERI-UCB-a0b0dbcb-7
0.358
KRI-MAR-d2e3ef86-15
0.353
ERI-UCB-a0b0dbcb-8
0.352
MIC-UNK-50cce87d-9
0.352
MIC-UNK-50cce87d-12
0.352
MAT-UCB-70f7c0f7-4
0.350
MAT-UCB-70f7c0f7-3
0.346
DAR-DIA-53551c05-15
0.344
GIA-UNK-80c9bc96-1
0.343
EDG-MED-5d232de5-7
0.343
PET-UNK-c9c1e0d8-4
0.343
EDG-MED-5d232de5-8
0.343
KRI-MAR-d2e3ef86-12
0.343
MAK-UNK-df1a028e-2
0.343
ALP-POS-ddb41b15-2
0.342
ALP-POS-ddb41b15-1
0.342
ROB-UNI-daaf9793-1
0.340
MAT-POS-e1b5ac6b-1
0.340
ALP-POS-ddb41b15-3
0.339
ALP-POS-fc6c627f-3
0.339
ERI-UCB-ce40166b-18
0.339
MIC-UNK-50cce87d-10
0.337
ALP-POS-05819dc4-1
0.336
PET-UNK-7b413b46-3
0.336
PET-UNK-7b413b46-7
0.336
ERI-UCB-ce40166b-17
0.336
MAT-POS-590ac91e-54
0.336
ALP-POS-3fc1724e-2
0.336
EDJ-MED-edeb0d3a-1
0.333
PET-UNK-7b413b46-2
0.333
PET-UNK-7b413b46-6
0.333