Molecular Properties | |
SMILES: | OC(CNc1nc(Cl)cc2ccccc12)c1ccc(Cl)cc1 |
MW: | 332.05 |
Fraction sp3: | 0.12 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 45.15 |
cLogP: | 4.69 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2021-05-26 |
2-halo pyridine
α-Halogen substituted N-heterocycles
Filter94_2_halo_pyridine
2-chloropyridine
2-halopyridine
halo-pyridine,_-diazoles_and_-triazoles
RAL-THA-2d450e86-2
0.271
MAR-LAB-ff9967db-13
0.267
SRE-UNK-d6ec0668-1
0.267
SRE-UNK-f31cebfc-1
0.267
MAT-POS-3cc264b0-1
0.256
EDJ-MED-50fe53e8-1
0.256
MAT-POS-de59a476-1
0.256
MAT-POS-fce787c2-4
0.256
VLA-UNK-9a7dc93f-6
0.250
MAT-POS-de59a476-5
0.247
RYA-UNI-14580791-1
0.244
RAL-THA-1d44ff04-6
0.242
MAT-POS-de59a476-4
0.242
MAT-POS-1f3f1a6f-4
0.240
ROB-UNI-322e8f70-1
0.240
MAT-POS-bbbbc21a-1
0.240
RAL-THA-2d450e86-29
0.240
MAT-POS-3b92565d-1
0.240
MIC-UNK-16ccb665-3
0.240
RAL-THA-2d450e86-30
0.239
MAT-POS-fce787c2-2
0.239
MAR-TRE-66ac689e-49
0.238
MAT-POS-fce787c2-11
0.237
RAL-THA-2d450e86-6
0.237
MAT-POS-4223bc15-33
0.234
MAT-POS-de59a476-2
0.234
ADA-UCB-6c2cb422-1
0.233
KRI-MAR-d2e3ef86-17
0.233
PET-UNK-1b92fa34-1
0.233
JOH-UNI-ee5ed7c8-6
0.232
JOH-UNI-3fc3434e-6
0.232
MAT-POS-1f3f1a6f-2
0.232
VLA-UNK-9a7dc93f-7
0.232
KEI-TRE-fa9ada3e-2
0.231
MAR-TRE-fffca54f-80
0.231
MAR-TRE-fffca54f-86
0.231
PET-UNK-407a74a5-7
0.231
RAL-THA-a9c31980-4
0.230
EDJ-MED-c99b2211-2
0.230
DAR-DIA-6a49afbe-12
0.230
MAT-POS-281d2ee9-1
0.230
MAT-POS-4223bc15-27
0.229
RAL-THA-1d44ff04-4
0.229
MAT-POS-1f3f1a6f-1
0.228
PET-UNK-8922bd3c-1
0.228
NAU-LAT-2fed8305-5
0.228
MAT-POS-fce787c2-3
0.228
MAR-TRE-66ac689e-79
0.227
MAR-TRE-66ac689e-80
0.227
RAL-THA-2d450e86-17
0.227
MAT-POS-cc05818f-1
0.227
ALP-POS-f13221e1-3
0.226
PET-UNK-dd44aeb6-2
0.226
RAL-THA-2d450e86-25
0.226
RAL-THA-2d450e86-27
0.226
PET-UNK-dd44aeb6-1
0.226
RAL-THA-2d450e86-24
0.226
PET-UNK-8c422e11-4
0.225
MIC-UNK-644c43c7-4
0.225
MAR-TRE-fffca54f-63
0.225
MIC-UNK-482af05e-1
0.225
EDJ-MED-cf4b0d25-4
0.224
PET-UNK-1b92fa34-5
0.224
DAR-DIA-6a49afbe-7
0.223
RAL-THA-2d450e86-15
0.223
PET-UNK-3c72d439-1
0.223
RAL-THA-2d450e86-9
0.223
DAR-DIA-6a49afbe-8
0.223
DAN-RED-da448e80-9
0.223
RAL-THA-2d450e86-14
0.223
MAR-UCB-6ab2ec87-7
0.223
DAR-DIA-9f765dc6-7
0.223
DAR-DIA-9f765dc6-8
0.223
DAR-DIA-9f765dc6-9
0.223
UNK-UNK-2ede4078-4
0.222
PET-UNK-162c14b2-1
0.222
BEN-DND-32596b04-3
0.222
MAT-POS-61f37a1a-12
0.222
PET-UNK-8c422e11-1
0.222
BAR-COM-655b106d-4
0.222
RAL-THA-1d44ff04-3
0.222
AAR-POS-d2a4d1df-39
0.222
MIC-UNK-df9dcda8-4
0.222
MAT-POS-2e8b2191-1
0.222
PET-UNK-0d6841fa-7
0.221
MIC-UNK-d36ab305-4
0.221
ALP-POS-1460fd94-3
0.221
MAT-POS-fce787c2-10
0.221
MAT-POS-fce787c2-5
0.221
PET-UNK-bb7ffe78-1
0.221
VLA-UNK-9a7dc93f-1
0.221
EDJ-MED-e9a22d5d-1
0.220
MAT-POS-4223bc15-6
0.220
MIC-UNK-df9dcda8-1
0.220
PET-UNK-8c422e11-3
0.220
MIC-UNK-16ccb665-2
0.220
MIC-UNK-16ccb665-1
0.220
NAU-LAT-2fed8305-9
0.220
NAU-LAT-2fed8305-6
0.220
MAT-POS-23a8a11a-1
0.220