Molecular Properties | |
SMILES: | O=C(CC1CCCCC1)Nc1c(F)ncc2ncncc12 |
MW: | 288.326 |
Fraction sp3: | 0.47 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 67.77 |
cLogP: | 3.0728 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
2-halo pyridine
α-Halogen substituted N-heterocycles
Filter94_2_halo_pyridine
2-halopyridine
SID-ELM-8b394441-19
0.662
SID-ELM-b654bfa2-10
0.622
SID-ELM-b654bfa2-14
0.553
SID-ELM-2583a2cd-13
0.547
SID-ELM-b654bfa2-11
0.539
SID-ELM-b654bfa2-15
0.519
SID-ELM-b654bfa2-22
0.494
SID-ELM-b654bfa2-20
0.463
SID-ELM-b654bfa2-21
0.453
SID-ELM-b654bfa2-12
0.439
SID-ELM-8b394441-20
0.429
SID-ELM-8b394441-26
0.427
SID-ELM-b654bfa2-8
0.418
SID-ELM-b654bfa2-9
0.412
SID-ELM-8b394441-25
0.410
SID-ELM-8b394441-2
0.403
SID-ELM-b654bfa2-13
0.398
SID-ELM-2583a2cd-16
0.395
SID-ELM-8b394441-21
0.393
SID-ELM-2583a2cd-21
0.388
SID-ELM-8b394441-24
0.388
FRA-FAC-9ed5a63a-1
0.382
ALE-HEI-f28a35b5-9
0.382
AAR-POS-d2a4d1df-13
0.382
TRY-UNI-714a760b-1
0.380
CHA-KIN-ceadbd93-2
0.380
SID-ELM-8b394441-16
0.375
EDG-MED-0da5ad92-4
0.372
ALE-HEI-f28a35b5-6
0.372
TRY-UNI-714a760b-10
0.372
SID-ELM-2583a2cd-2
0.369
SID-ELM-2583a2cd-12
0.369
SID-ELM-2583a2cd-3
0.369
SID-ELM-8b394441-22
0.368
SID-ELM-2583a2cd-19
0.367
SID-ELM-2583a2cd-15
0.358
SID-ELM-2583a2cd-1
0.353
SID-ELM-8b394441-4
0.350
SID-ELM-2583a2cd-18
0.349
SID-ELM-8b394441-17
0.345
SID-ELM-8b394441-18
0.341
CHA-KIN-ceadbd93-6
0.330
SID-ELM-2583a2cd-4
0.330
SID-ELM-8b394441-23
0.326
SID-ELM-8b394441-8
0.322
DAR-DIA-03336633-5
0.320
MED-UNK-e6e8ef8a-8
0.302
MAK-UNK-b2c98f02-3
0.296
MAK-UNK-b2c98f02-1
0.293
MAK-UNK-b2c98f02-4
0.287
MAK-UNK-b2c98f02-2
0.287
SID-ELM-b654bfa2-4
0.281
FRA-FAC-9ed5a63a-2
0.259
MED-UNK-e6e8ef8a-3
0.259
MED-UNK-e6e8ef8a-2
0.259
EDG-MED-0da5ad92-9
0.258
MAK-UNK-748f8b7a-7
0.253
SID-ELM-2583a2cd-17
0.247
MAR-TRE-92684b97-83
0.244
LEO-EVO-0d2ed6fc-1
0.242
SID-ELM-b654bfa2-17
0.239
SAN-PRS-52b81272-1
0.238
SAD-SAT-cefd50cc-4
0.238
SID-ELM-1f105489-4
0.234
SID-ELM-1f105489-13
0.234
MAK-UNK-f2409524-9
0.233
LEO-EVO-0d2ed6fc-7
0.230
LYN-UNI-c2dd631d-2
0.230
RUB-POS-1325a9ea-18
0.229
WAR-XCH-bdd24732-36
0.229
VLA-UCB-34f3ed0c-6
0.227
RAL-MED-2de63afb-14
0.227
SID-ELM-b654bfa2-18
0.226
MAK-UNK-f2409524-14
0.225
MAK-UNK-f2409524-10
0.225
MAT-POS-ea426761-43
0.224
JOR-UNI-2fc98d0b-12
0.223
JOR-UNI-61e7b1d5-19
0.223
MAR-TRE-9d18ae8c-93
0.222
LEO-EVO-0d2ed6fc-4
0.220
MAR-TRE-4f781e27-64
0.220
MAK-UNK-748f8b7a-16
0.220
MAK-UNK-f2409524-3
0.219
MED-UNK-e6e8ef8a-5
0.218
MAK-UNK-f2409524-1
0.218
MAK-UNK-f2409524-26
0.218
JOR-UNI-61e7b1d5-18
0.217
MAK-UNK-f2409524-28
0.217
MAK-UNK-f2409524-2
0.216
MAK-UNK-f2409524-15
0.216
YOI-UNK-4c10088f-1
0.215
MAK-UNK-c749d764-13
0.215
SID-ELM-b654bfa2-7
0.215
LEO-EVO-0d2ed6fc-2
0.215
MIC-UNK-c66144cb-3
0.214
CES-WAB-18e74d70-1
0.214
PET-SGC-c429dc17-1
0.214
MAR-TRE-b77b7921-53
0.214
AAR-UNI-c25c2f1e-96
0.214
ALP-POS-3b848b35-4
0.214