Molecular Properties | |
SMILES: | O=C(Nc1cc(Cl)nc2ccccc12)C1CC2CC1CN2C(=O)CCl |
MW: | 377.07 |
Fraction sp3: | 0.39 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 62.3 |
cLogP: | 3.3 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
2-halo pyridine
α-Halogen substituted N-heterocycles
Filter94_2_halo_pyridine
2-chloropyridine
2-halopyridine
halo-pyridine,_-diazoles_and_-triazoles
MED-COV-4280ac29-15
LON-WEI-120e5cf5-14
0.580
MAK-UNK-3f402c2b-19
0.571
MAK-UNK-5d2caa6f-21
0.570
MAK-UNK-5d2caa6f-20
0.545
MAK-UNK-5d2caa6f-15
0.506
MAK-UNK-5d2caa6f-16
0.500
MAK-UNK-5d2caa6f-1
0.494
MAK-UNK-90d0606b-9
0.488
MAK-UNK-3e0761f8-5
0.488
MAK-UNK-3e0761f8-3
0.484
MAK-UNK-5d2caa6f-14
0.479
MAK-UNK-5d2caa6f-22
0.473
MAK-UNK-90d0606b-8
0.471
MAK-UNK-90d0606b-2
0.471
MAK-UNK-3e0761f8-1
0.470
MAK-UNK-ec98eaf6-5
0.455
MAK-UNK-90d0606b-10
0.449
MAK-UNK-5d2caa6f-19
0.442
MAK-UNK-5d2caa6f-17
0.430
MAK-UNK-3e0761f8-8
0.417
MAK-UNK-5d2caa6f-18
0.406
MAK-UNK-5d2caa6f-11
0.396
MAK-UNK-3f402c2b-28
0.366
MAK-UNK-3f402c2b-18
0.356
MAK-UNK-3f402c2b-20
0.345
MAK-UNK-ec98eaf6-43
0.333
MAK-UNK-ec98eaf6-36
0.330
MAK-UNK-10799360-24
0.327
MAK-UNK-10799360-25
0.324
MAK-UNK-ec98eaf6-32
0.323
MAK-UNK-5d2caa6f-9
0.312
MAK-UNK-3f402c2b-22
0.303
DAR-DIA-3e9bbd81-1
0.303
MAK-UNK-ec98eaf6-38
0.301
MAK-UNK-3f402c2b-8
0.299
MAK-UNK-df1a028e-5
0.298
MAK-UNK-ec98eaf6-48
0.297
DAR-DIA-caba39e3-7
0.294
MAK-UNK-10799360-34
0.291
MAK-UNK-ec98eaf6-35
0.291
MAK-UNK-df1a028e-7
0.290
MAK-UNK-3e0761f8-6
0.288
MAK-UNK-90d0606b-1
0.287
MAK-UNK-5d2caa6f-7
0.284
MAK-UNK-3f402c2b-7
0.284
MAK-UNK-3e0761f8-7
0.283
WAR-XCH-b0339bbe-19
0.283
DAN-LON-a5fc619e-8
0.283
DAR-DIA-caba39e3-8
0.282
DAR-DIA-3e9bbd81-5
0.280
MAK-UNK-ec98eaf6-37
0.279
MAK-UNK-3f402c2b-14
0.278
TAT-ENA-80bfd3e5-13
0.278
AAR-POS-d2a4d1df-30
0.278
MAK-UNK-bae89c02-2
0.278
MAK-UNK-df1a028e-9
0.278
MAR-TRE-6a44bbf2-53
0.277
MAK-UNK-7c9d1431-25
0.277
MIH-UNI-e573136b-2
0.275
PEI-IMP-e4a008a2-1
0.275
MAR-TRE-3e4e6814-31
0.275
MAK-UNK-5d2caa6f-3
0.274
MAK-UNK-df1a028e-1
0.274
MAK-UNK-ec98eaf6-7
0.274
WAR-XCH-bdd24732-16
0.273
MAK-UNK-a7992eb3-1
0.272
MAK-UNK-10799360-2
0.272
MAK-UNK-3f402c2b-16
0.272
MAK-UNK-3f402c2b-26
0.272
MIK-MCD-8542a490-1
0.271
MAK-UNK-90d0606b-6
0.271
MAK-UNK-3f402c2b-2
0.271
DAN-LON-a5fc619e-5
0.270
MAK-UNK-ec98eaf6-11
0.269
MAK-UNK-ec98eaf6-19
0.269
MAK-UNK-ec98eaf6-24
0.269
LON-WEI-120e5cf5-16
0.269
MAK-UNK-df1a028e-6
0.269
MIH-UNI-e573136b-10
0.268
DAR-DIA-3e9bbd81-3
0.267
MAK-UNK-3f402c2b-25
0.267
DAR-DIA-3e9bbd81-2
0.267
MAK-UNK-ec98eaf6-2
0.267
MAK-UNK-3f402c2b-3
0.266
SEB-HKI-06b43755-1
0.265
MAK-UNK-69bf97dd-4
0.264
MAK-UNK-3f402c2b-27
0.264
MAK-UNK-10799360-11
0.264
KAD-UNI-8a629cb0-14
0.264
MAK-UNK-10799360-10
0.263
MAT-POS-4223bc15-33
0.263
MAK-UNK-a7992eb3-4
0.262
LON-WEI-120e5cf5-7
0.262
SWA-SYN-d2e6fa14-2
0.261
SWA-SYN-6423ea73-2
0.261
AAR-POS-0daf6b7e-6
0.261
MAR-TRE-6a44bbf2-15
0.261
MAC-MCD-4707377b-1
0.260
MAK-UNK-3f402c2b-11
0.260
MAK-UNK-10799360-36
0.260