Molecular Properties | |
SMILES: | O=C(CC1CCCCC1)Nc1c(F)ncc2[nH]cnc12 |
MW: | 276.315 |
Fraction sp3: | 0.5 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 70.67 |
cLogP: | 3.0059 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
2-halo pyridine
α-Halogen substituted N-heterocycles
Filter94_2_halo_pyridine
2-halopyridine
SID-ELM-8b394441-24
0.671
SID-ELM-b654bfa2-11
0.568
SID-ELM-b654bfa2-15
0.547
SID-ELM-b654bfa2-14
0.539
SID-ELM-2583a2cd-18
0.533
SID-ELM-b654bfa2-19
0.480
SID-ELM-b654bfa2-16
0.463
SID-ELM-b654bfa2-10
0.451
SID-ELM-8b394441-21
0.450
SID-ELM-b654bfa2-8
0.442
SID-ELM-b654bfa2-21
0.440
SID-ELM-8b394441-25
0.432
SID-ELM-b654bfa2-12
0.427
ALE-HEI-f28a35b5-9
0.425
FRA-FAC-9ed5a63a-1
0.425
AAR-POS-d2a4d1df-13
0.425
SID-ELM-b654bfa2-9
0.418
SID-ELM-8b394441-2
0.408
SID-ELM-b654bfa2-13
0.402
SID-ELM-8b394441-26
0.398
SID-ELM-8b394441-19
0.393
SID-ELM-8b394441-20
0.384
SID-ELM-8b394441-17
0.383
SID-ELM-8b394441-16
0.380
SID-ELM-2583a2cd-3
0.373
SID-ELM-2583a2cd-2
0.373
SID-ELM-2583a2cd-12
0.373
SID-ELM-2583a2cd-1
0.373
SID-ELM-2583a2cd-19
0.372
SID-ELM-2583a2cd-16
0.364
SID-ELM-8b394441-18
0.361
ALE-HEI-f28a35b5-6
0.359
EDG-MED-0da5ad92-4
0.359
TRY-UNI-714a760b-10
0.359
SID-ELM-8b394441-22
0.356
SID-ELM-8b394441-4
0.354
CHA-KIN-ceadbd93-2
0.350
TRY-UNI-714a760b-1
0.350
SID-ELM-2583a2cd-15
0.346
SID-ELM-2583a2cd-13
0.337
SID-ELM-2583a2cd-21
0.330
SID-ELM-8b394441-23
0.330
MAK-UNK-b2c98f02-3
0.326
SID-ELM-8b394441-13
0.321
CHA-KIN-ceadbd93-6
0.319
SID-ELM-2583a2cd-4
0.318
MED-UNK-e6e8ef8a-8
0.305
MAK-UNK-b2c98f02-1
0.296
DAR-DIA-03336633-5
0.296
MED-UNK-e6e8ef8a-3
0.293
MED-UNK-e6e8ef8a-2
0.293
FRA-FAC-9ed5a63a-2
0.293
SID-ELM-b654bfa2-17
0.284
MAK-UNK-b2c98f02-4
0.277
MAK-UNK-b2c98f02-2
0.277
MAR-TRE-b77b7921-53
0.255
KEI-TRE-d5e2018a-77
0.255
MED-UNK-e6e8ef8a-5
0.250
MAR-TRE-e82e6c98-18
0.250
SID-ELM-2583a2cd-9
0.247
WAR-XCH-bdd24732-36
0.245
MAR-TRE-b77b7921-59
0.243
MAR-TRE-f5c2d31c-93
0.242
SID-ELM-b654bfa2-18
0.242
MED-UNK-e6e8ef8a-4
0.241
SAN-PRS-52b81272-1
0.241
ALE-HEI-f28a35b5-8
0.241
MAT-POS-ea426761-43
0.240
JOH-IMS-62aeb97d-1
0.238
JOR-UNI-2fc98d0b-12
0.238
MED-UNK-e6e8ef8a-7
0.235
MAR-TRE-67513f76-90
0.233
MAR-TRE-92684b97-83
0.233
EDG-MED-0da5ad92-9
0.233
MAK-UNK-b2c98f02-9
0.233
JOR-UNI-61e7b1d5-20
0.233
MAR-TRE-3e4e6814-49
0.232
JOR-UNI-61e7b1d5-21
0.231
JOR-UNI-61e7b1d5-18
0.231
SID-ELM-b654bfa2-7
0.231
SAD-SAT-cefd50cc-4
0.228
JOR-UNI-61e7b1d5-19
0.225
ZAC-WAB-d55a3c2e-2
0.224
ZAC-WAB-3baddbb3-1
0.224
WAR-XCH-bdd24732-37
0.223
ASH-UNK-40b46b30-13
0.221
MED-UNK-e6e8ef8a-1
0.221
VLA-UCB-34f3ed0c-6
0.218
MAK-UNK-b2c98f02-7
0.217
FRA-LAB-04e32718-1
0.216
JON-UNI-57097b3f-7
0.216
MAR-TRE-3724962b-10
0.216
ALP-POS-e980f4ea-13
0.216
ALP-POS-e980f4ea-22
0.216
MAR-TRE-7f7bb9f0-58
0.214
MAR-TRE-7f7bb9f0-56
0.213
MAK-UNK-f2409524-10
0.213
MAR-TRE-3e4e6814-62
0.213
BAR-COM-0f94fc3d-22
0.212
MAR-TRE-f6f5f473-53
0.212