Molecular Properties | |
SMILES: | O=C(CC1CCCCC1)Nc1c(Cl)ncc2[nH]ncc12 |
MW: | 292.77 |
Fraction sp3: | 0.5 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 70.67 |
cLogP: | 3.5202 |
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
SID-ELM-b654bfa2-14
0.671
SID-ELM-8b394441-21
0.634
SID-ELM-8b394441-19
0.560
SID-ELM-8b394441-24
0.560
SID-ELM-2583a2cd-12
0.541
SID-ELM-8b394441-20
0.526
SID-ELM-8b394441-26
0.487
SID-ELM-8b394441-14
0.474
SID-ELM-8b394441-22
0.457
SID-ELM-b654bfa2-11
0.450
SID-ELM-8b394441-4
0.446
SID-ELM-8b394441-17
0.436
SID-ELM-8b394441-16
0.434
SID-ELM-b654bfa2-20
0.432
SID-ELM-8b394441-18
0.412
SID-ELM-b654bfa2-16
0.410
SID-ELM-8b394441-23
0.410
SID-ELM-2583a2cd-1
0.390
SID-ELM-b654bfa2-10
0.384
SID-ELM-b654bfa2-15
0.381
SID-ELM-2583a2cd-21
0.376
SID-ELM-b654bfa2-12
0.376
SID-ELM-2583a2cd-19
0.372
SID-ELM-b654bfa2-8
0.370
SID-ELM-2583a2cd-13
0.369
SID-ELM-2583a2cd-18
0.369
AAR-POS-d2a4d1df-13
0.368
FRA-FAC-9ed5a63a-1
0.368
ALE-HEI-f28a35b5-9
0.368
SID-ELM-b654bfa2-21
0.367
SID-ELM-2583a2cd-16
0.364
EDG-MED-0da5ad92-4
0.359
TRY-UNI-714a760b-10
0.359
ALE-HEI-f28a35b5-6
0.359
SID-ELM-2583a2cd-2
0.357
SID-ELM-8b394441-2
0.354
SID-ELM-b654bfa2-13
0.353
TRY-UNI-714a760b-1
0.350
CHA-KIN-ceadbd93-2
0.350
SID-ELM-b654bfa2-9
0.349
SID-ELM-2583a2cd-15
0.346
SID-ELM-2583a2cd-3
0.341
SID-ELM-2583a2cd-4
0.333
SID-ELM-b654bfa2-18
0.314
CHA-KIN-ceadbd93-6
0.304
MAK-UNK-b2c98f02-3
0.299
SID-ELM-8b394441-10
0.299
DAR-DIA-03336633-5
0.296
MAK-UNK-b2c98f02-1
0.296
MED-UNK-e6e8ef8a-8
0.292
MAK-UNK-b2c98f02-2
0.277
MAK-UNK-b2c98f02-4
0.277
VLA-UCB-34f3ed0c-6
0.264
MED-UNK-e6e8ef8a-3
0.262
EDJ-MED-c314995a-1
0.257
VLA-UCB-05e51b3f-14
0.257
JOR-UNI-2fc98d0b-12
0.250
ADA-UCB-dc2b944c-3
0.248
ADA-UCB-dc2b944c-17
0.248
RUB-POS-1325a9ea-13
0.247
SID-ELM-8b394441-13
0.247
EDG-MED-0da5ad92-9
0.247
MAR-TRE-92684b97-83
0.247
FRA-FAC-9ed5a63a-2
0.247
MED-UNK-e6e8ef8a-2
0.247
MAK-UNK-c749d764-26
0.245
MAT-POS-136e7878-1
0.243
SAD-SAT-cefd50cc-4
0.240
SID-ELM-8b394441-8
0.239
ADA-UCB-dc2b944c-2
0.239
MAT-UCB-93f6aed8-2
0.239
MIC-UNK-bcd487e9-2
0.236
YOI-UNK-4c10088f-1
0.234
MAT-POS-199e2e7c-2
0.232
MAT-POS-136e7878-2
0.231
MAT-POS-53907a1c-3
0.231
ALP-POS-3fc1724e-8
0.229
SAD-SAT-edc8a235-1
0.229
ALP-POS-3b848b35-4
0.227
MIC-UNK-c66144cb-3
0.227
MIC-UNK-cdc2493e-1
0.226
SAN-PRS-52b81272-1
0.226
VLA-UCB-00f2c2b3-7
0.226
DAR-DIA-1d7f034a-1
0.224
MAR-UCB-ad2ff052-3
0.224
MAR-TRE-e82e6c98-61
0.223
WAR-XCH-bdd24732-13
0.223
MAT-POS-53907a1c-2
0.223
MAT-UCB-93f6aed8-1
0.222
MAK-UNK-ffc90da7-2
0.222
MAK-UNK-c749d764-12
0.222
SID-ELM-2583a2cd-10
0.222
MAK-UNK-b2c98f02-9
0.221
MAK-UNK-f2409524-9
0.221
ROD-LAS-d5538ff9-3
0.221
MED-UNK-e6e8ef8a-7
0.221
AAR-POS-0daf6b7e-20
0.221
JOR-UNI-61e7b1d5-18
0.219
MIC-UNK-d935700b-2
0.219
MAK-UNK-f2409524-15
0.218