Molecular Properties | |
SMILES: | O=c1c2cc(F)c(Cl)cc2n(-c2cccc(Cl)c2)c(=O)n1-c1cccnc1 |
MW: | 402.212 |
Fraction sp3: | 0.0 |
HBA: | 5 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 56.89 |
cLogP: | 3.9825 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
AAR-POS-d2a4d1df-11
MAK-UNK-9e4a73aa-18
0.797
MAK-UNK-9e4a73aa-33
0.764
MAK-UNK-9e4a73aa-27
0.739
RAI-NOV-c18e0037-2
0.739
MAK-UNK-9e4a73aa-26
0.739
MAK-UNK-9e4a73aa-19
0.739
MAK-UNK-9e4a73aa-23
0.739
MAK-UNK-9e4a73aa-24
0.739
MAK-UNK-9e4a73aa-22
0.739
MAK-UNK-9e4a73aa-25
0.739
MAK-UNK-9e4a73aa-34
0.708
MAK-UNK-9e4a73aa-17
0.615
MAK-UNK-9e4a73aa-32
0.600
MAK-UNK-9e4a73aa-12
0.592
MAK-UNK-9e4a73aa-11
0.560
MAK-UNK-9e4a73aa-10
0.553
MAK-UNK-9e4a73aa-28
0.544
MAK-UNK-9e4a73aa-16
0.532
MAK-UNK-9e4a73aa-15
0.526
MAK-UNK-9e4a73aa-7
0.525
MAK-UNK-9e4a73aa-1
0.521
MAK-UNK-9e4a73aa-8
0.506
MAK-UNK-9e4a73aa-29
0.500
MAK-UNK-9e4a73aa-35
0.471
MAK-UNK-9e4a73aa-14
0.470
MAK-UNK-9e4a73aa-13
0.452
RAI-NOV-c18e0037-4
0.449
MAK-UNK-9e4a73aa-36
0.448
MAK-UNK-9e4a73aa-31
0.448
PET-UNK-94460c07-5
0.444
MAK-UNK-9e4a73aa-21
0.435
RAI-NOV-c18e0037-1
0.434
MAK-UNK-9e4a73aa-20
0.430
MAK-UNK-9e4a73aa-9
0.429
MAK-UNK-9e4a73aa-30
0.425
PET-UNK-94460c07-6
0.402
PET-UNK-4dc48bbe-5
0.390
PET-UNK-4dc48bbe-3
0.352
RAI-NOV-c18e0037-6
0.333
JAN-GHE-83b26c96-18
0.333
RAI-NOV-c18e0037-5
0.330
RAI-NOV-c18e0037-7
0.329
PET-UNK-4dc48bbe-2
0.322
PET-UNK-4dc48bbe-7
0.318
DAR-DIA-5d6f1b43-15
0.314
DAR-DIA-5d6f1b43-9
0.312
DAR-DIA-5d6f1b43-16
0.311
STE-UNK-28609fce-1
0.310
NIM-UNI-0ea3b7bf-4
0.309
DAR-DIA-0f7b7cd9-6
0.309
DAR-DIA-5d6f1b43-33
0.308
DAR-DIA-5d6f1b43-14
0.304
MAK-UNK-9e4a73aa-3
0.302
MAR-TRE-74c6519b-18
0.301
PET-UNK-4dc48bbe-1
0.293
MAK-UNK-9e4a73aa-2
0.289
HAO-BIO-c9aafde3-11
0.287
PET-UNK-7a31b064-5
0.284
DAR-DIA-fc970077-3
0.282
ADA-UCB-6c2cb422-6
0.278
PET-UNK-7a31b064-6
0.278
DAR-DIA-5d6f1b43-17
0.278
DAR-DIA-5d6f1b43-21
0.278
PET-UNK-4dc48bbe-9
0.273
EDJ-MED-e66f2cc5-2
0.272
DAR-DIA-5d6f1b43-2
0.271
DAR-DIA-5d6f1b43-32
0.269
ERI-UCB-ce40166b-22
0.264
PET-UNK-94460c07-3
0.263
PET-UNK-5eca9d1d-2
0.263
ERI-UCB-ce40166b-24
0.262
WAR-XCH-eb7b662f-7
0.262
DAR-DIA-23aa0b97-14
0.262
JOR-UNI-2fc98d0b-7
0.262
JAN-GHE-83b26c96-19
0.262
NIM-UNI-534877e5-2
0.261
DAR-DIA-5d6f1b43-19
0.259
CHR-SOS-7098f804-12
0.259
DAR-DIA-5d6f1b43-22
0.257
DAR-DIA-5d6f1b43-31
0.257
MAR-TRE-74c6519b-26
0.256
MAT-POS-67c9d7d9-1
0.256
MAR-TRE-b77b7921-33
0.255
EDJ-MED-49816e9b-6
0.253
PET-UNK-b870596d-1
0.253
SAD-SAT-135344c3-8
0.252
NIM-UNI-7f77122c-3
0.252
MAK-UNK-9e4a73aa-5
0.250
DAR-DIA-5d6f1b43-18
0.250
DAR-DIA-5d6f1b43-28
0.250
VLA-UNK-792b5d03-4
0.248
DAR-DIA-5d6f1b43-30
0.248
DAR-DIA-5d6f1b43-23
0.248
PET-UNK-4dc48bbe-4
0.248
NIM-UNI-0ea3b7bf-1
0.247
JAG-UCB-cedd89ab-1
0.247
MIC-UNK-5ce21166-1
0.247
PET-UNK-94460c07-1
0.245
NIM-UNI-7f77122c-1
0.245
NIM-UNI-36e12f95-3
0.245