Molecular Properties | |
SMILES: | O=C(CC1CCCCC1)Nc1c(F)ncc2ncccc12 |
MW: | 287.338 |
Fraction sp3: | 0.44 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 54.88 |
cLogP: | 3.6778 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
2-halo pyridine
α-Halogen substituted N-heterocycles
Filter94_2_halo_pyridine
2-halopyridine
SID-ELM-8b394441-20
0.671
SID-ELM-b654bfa2-16
0.622
SID-ELM-b654bfa2-15
0.545
SID-ELM-b654bfa2-11
0.545
SID-ELM-2583a2cd-21
0.538
SID-ELM-b654bfa2-14
0.519
SID-ELM-b654bfa2-4
0.506
SID-ELM-8b394441-2
0.486
SID-ELM-b654bfa2-12
0.481
SID-ELM-b654bfa2-20
0.451
SID-ELM-8b394441-26
0.451
SID-ELM-b654bfa2-21
0.442
SID-ELM-8b394441-4
0.429
SID-ELM-8b394441-19
0.429
FRA-FAC-9ed5a63a-1
0.427
AAR-POS-d2a4d1df-13
0.427
ALE-HEI-f28a35b5-9
0.427
SID-ELM-b654bfa2-8
0.407
SID-ELM-8b394441-22
0.407
SID-ELM-b654bfa2-13
0.405
SID-ELM-b654bfa2-9
0.402
SID-ELM-8b394441-21
0.400
CHA-KIN-ceadbd93-2
0.388
SID-ELM-8b394441-25
0.384
ALE-HEI-f28a35b5-6
0.380
TRY-UNI-714a760b-10
0.380
EDG-MED-0da5ad92-4
0.380
SID-ELM-8b394441-24
0.379
SID-ELM-2583a2cd-3
0.376
SID-ELM-2583a2cd-13
0.372
MAK-UNK-b2c98f02-1
0.368
SID-ELM-2583a2cd-16
0.367
SID-ELM-8b394441-16
0.366
SID-ELM-2583a2cd-2
0.360
TRY-UNI-714a760b-1
0.354
SID-ELM-8b394441-17
0.353
SID-ELM-2583a2cd-4
0.352
MED-UNK-e6e8ef8a-8
0.351
SID-ELM-8b394441-23
0.348
SID-ELM-2583a2cd-1
0.345
SID-ELM-2583a2cd-19
0.341
CHA-KIN-ceadbd93-6
0.337
MAK-UNK-b2c98f02-4
0.333
SID-ELM-2583a2cd-15
0.333
SID-ELM-8b394441-9
0.333
SID-ELM-8b394441-18
0.333
MAK-UNK-b2c98f02-3
0.330
SID-ELM-2583a2cd-12
0.330
DAR-DIA-03336633-5
0.327
SID-ELM-2583a2cd-18
0.326
MAK-UNK-b2c98f02-2
0.320
SID-ELM-b654bfa2-22
0.315
FRA-FAC-9ed5a63a-2
0.298
MED-UNK-e6e8ef8a-2
0.298
MED-UNK-e6e8ef8a-3
0.298
SAN-PRS-52b81272-1
0.277
ALE-HEI-f28a35b5-8
0.277
WAR-XCH-bdd24732-36
0.277
MAR-TRE-b77b7921-59
0.272
NIC-BIO-25446079-2
0.272
COM-UCB-1ef4e90e-16
0.270
SID-ELM-b654bfa2-7
0.264
RUB-POS-1325a9ea-18
0.263
DAR-DIA-23aa0b97-18
0.263
SID-ELM-b654bfa2-17
0.261
NIM-UNI-bb9030bf-10
0.260
MIC-UNK-08cd9c58-1
0.260
MAT-POS-f7918075-3
0.260
JOR-UNI-61e7b1d5-18
0.260
MED-UNK-e6e8ef8a-5
0.256
WAR-XCH-bdd24732-37
0.255
EDG-MED-0da5ad92-9
0.253
SID-ELM-2583a2cd-20
0.253
MAR-TRE-f6f5f473-53
0.252
JOR-UNI-61e7b1d5-19
0.252
JOR-UNI-61e7b1d5-20
0.250
MAR-TRE-b77b7921-22
0.250
MAK-UNK-b2c98f02-9
0.250
BAR-COM-0f94fc3d-52
0.250
ZAC-WAB-2baeb60f-1
0.248
ZAC-WAB-d55a3c2e-1
0.248
MAR-TRE-3159af1a-49
0.248
KEI-TRE-d5e2018a-77
0.247
MAR-TRE-b77b7921-53
0.247
MED-UNK-e6e8ef8a-4
0.247
MAR-TRE-f6f5f473-26
0.245
VLA-UCB-34f3ed0c-6
0.245
IAN-BAS-b0010df8-1
0.243
JOR-UNI-2fc98d0b-12
0.243
MAR-UCB-195bc32d-13
0.241
MED-UNK-e6e8ef8a-7
0.241
MAR-TRE-3159af1a-70
0.241
MAR-TRE-f6f5f473-35
0.240
SWA-SYN-6423ea73-10
0.240
SWA-SYN-d2e6fa14-9
0.240
LYN-UNI-c2dd631d-2
0.239
MAR-TRE-f6f5f473-16
0.239
ZAC-WAB-86e8bacf-1
0.239
MAK-UNK-c749d764-13
0.237
JOR-UNI-61e7b1d5-21
0.236