Molecular Properties | |
SMILES: | O=C(NNc1nc2ccccc2o1)c1cc(=O)[nH]c2ccccc12 |
MW: | 320.09 |
Fraction sp3: | 0.0 |
HBA: | 5 |
HBD: | 3 |
Rotatable Bonds: | 3 |
TPSA: | 100.02 |
cLogP: | 2.43 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Oxygen-nitrogen single bond
Singel acyclic N-N bonds
Filter20_hydrazine
acyl hydrazine
Hetero_hetero
hydrazine
ALP-UNI-ed5cdfd2-5
0.560
ALP-UNI-ed5cdfd2-8
0.560
ALP-UNI-ed5cdfd2-6
0.494
ALP-UNI-ed5cdfd2-7
0.460
ALP-UNI-ed5cdfd2-2
0.424
ALP-UNI-ed5cdfd2-3
0.415
ALP-UNI-ed5cdfd2-1
0.411
NAU-LAT-56d5284e-4
0.411
NAU-LAT-56d5284e-7
0.409
BEN-DND-7e92b6ca-4
0.402
BEN-DND-7e92b6ca-5
0.398
KRI-MAR-d2e3ef86-15
0.394
DAR-DIA-8e329c92-4
0.392
DAR-DIA-8e329c92-9
0.391
MAT-UCB-70f7c0f7-4
0.389
MAT-POS-54c4bf04-1
0.389
ADA-UCB-b1b30a00-2
0.384
KRI-MAR-d2e3ef86-12
0.383
NAU-LAT-56d5284e-6
0.381
DAR-DIA-8e329c92-6
0.381
BEN-DND-7e92b6ca-3
0.380
ALP-POS-bea7b391-1
0.380
NAU-LAT-a5c7d7cb-7
0.379
DAR-DIA-8e329c92-11
0.378
DAR-DIA-8e329c92-5
0.376
ADA-UCB-b1b30a00-1
0.371
MAT-UCB-70f7c0f7-3
0.370
KRI-MAR-d2e3ef86-5
0.370
BEN-DND-7e92b6ca-10
0.370
MAT-POS-916a2c5a-2
0.368
BEN-DND-7e92b6ca-9
0.365
MAR-UCB-f313ec4d-4
0.365
DAR-DIA-8e329c92-7
0.362
DAR-DIA-8e329c92-10
0.361
ALP-POS-3fc1724e-3
0.361
DAR-DIA-8e329c92-8
0.358
ERI-UCB-a0b0dbcb-12
0.357
NAU-LAT-56d5284e-8
0.357
MAT-UCB-70f7c0f7-1
0.356
NAU-LAT-56d5284e-1
0.354
KRI-MAR-d2e3ef86-6
0.354
ERI-UCB-ce40166b-13
0.352
NAU-LAT-56d5284e-2
0.351
NAU-LAT-56d5284e-3
0.350
ERI-UCB-ce40166b-16
0.349
ERI-UCB-ce40166b-14
0.349
BEN-DND-7e92b6ca-6
0.348
ALP-POS-3fc1724e-1
0.347
ALP-POS-05819dc4-1
0.347
WIL-UNI-d4749f31-37
0.340
ERI-UCB-a0b0dbcb-14
0.340
ERI-UCB-ce40166b-15
0.340
MAT-UCB-70f7c0f7-2
0.339
MAT-POS-916a2c5a-4
0.337
EDJ-MED-78f964c8-1
0.337
DAR-DIA-53551c05-22
0.337
ERI-UCB-ce40166b-17
0.333
ALP-POS-3fc1724e-2
0.333
ERI-UCB-a0b0dbcb-5
0.333
DAR-DIA-8e329c92-12
0.330
ERI-UCB-a0b0dbcb-11
0.330
ERI-UCB-a0b0dbcb-13
0.330
ERI-UCB-d6de1f3c-8
0.330
ERI-UCB-d6de1f3c-1
0.330
ERI-UCB-a0b0dbcb-2
0.330
BEN-DND-7e92b6ca-14
0.330
JAN-GHE-82a280f8-1
0.327
KRI-MAR-d2e3ef86-13
0.327
BEN-DND-7e92b6ca-11
0.327
BEN-DND-7e92b6ca-15
0.327
BEN-DND-7e92b6ca-16
0.326
ERI-UCB-ce40166b-20
0.324
ERI-UCB-ce40166b-18
0.324
ERI-UCB-a0b0dbcb-8
0.324
VLA-UCB-eb340134-1
0.324
NAU-LAT-56d5284e-5
0.323
ERI-UCB-a0b0dbcb-10
0.320
VLA-UCB-eb340134-4
0.320
BEN-DND-7e92b6ca-7
0.320
ERI-UCB-a0b0dbcb-7
0.318
VLA-UCB-eb340134-2
0.317
VLA-UCB-eb340134-3
0.317
JAN-GHE-82a280f8-2
0.317
MAT-POS-916a2c5a-3
0.317
KRI-MAR-d2e3ef86-4
0.317
DAR-DIA-53551c05-20
0.316
MAK-UNK-df1a028e-3
0.316
DAR-DIA-8e329c92-13
0.316
ERI-UCB-ce40166b-19
0.315
ERI-UCB-a0b0dbcb-9
0.313
BEN-DND-7e92b6ca-13
0.313
ERI-UCB-d6de1f3c-3
0.313
ALP-POS-ddb41b15-3
0.312
KRI-MAR-d2e3ef86-7
0.310
ALP-POS-3fc1724e-4
0.309
MAT-POS-54c4bf04-4
0.308
ERI-UCB-a0b0dbcb-6
0.308
BEN-DND-7e92b6ca-12
0.307
MAR-UCB-f313ec4d-5
0.307
ERI-UCB-a0b0dbcb-3
0.307