Molecular Properties | |
SMILES: | C[C@H](C(=O)O)c1ccc2c(c1)[nH]c1ccc(Cl)nc12 |
MW: | 274.707 |
Fraction sp3: | 0.14 |
HBA: | 2 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 65.98 |
cLogP: | 3.5576 |
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
AAR-POS-d2a4d1df-30
MAK-UNK-0d6072ac-28
0.588
MAK-UNK-0d6072ac-29
0.535
MAK-UNK-0d6072ac-35
0.514
MAK-UNK-0d6072ac-30
0.514
MAK-UNK-0d6072ac-37
0.493
MAK-UNK-0d6072ac-3
0.493
AAR-POS-fca48359-20
0.493
MAK-UNK-0d6072ac-4
0.493
GER-UNI-ec786817-1
0.493
AAR-POS-fca48359-19
0.493
MAK-UNK-0d6072ac-16
0.486
MAK-UNK-0d6072ac-7
0.472
MAK-UNK-0d6072ac-18
0.465
MAK-UNK-0d6072ac-27
0.458
MAK-UNK-0d6072ac-8
0.432
MAK-UNK-0d6072ac-17
0.432
MAK-UNK-0d6072ac-1
0.431
MAK-UNK-0d6072ac-14
0.373
MAK-UNK-0d6072ac-24
0.359
MAK-UNK-0d6072ac-25
0.359
MAK-UNK-0d6072ac-5
0.355
MAK-UNK-0d6072ac-12
0.354
ALP-POS-4f3627cc-1
0.325
MAK-UNK-0d6072ac-10
0.325
MAK-UNK-0d6072ac-21
0.325
MAK-UNK-0d6072ac-20
0.316
MAK-UNK-0d6072ac-11
0.312
MAK-UNK-0d6072ac-33
0.309
MAK-UNK-0d6072ac-38
0.309
MAK-UNK-0d6072ac-19
0.308
AAR-POS-fca48359-18
0.308
MAK-UNK-0d6072ac-26
0.308
MAK-UNK-0d6072ac-36
0.305
MAK-UNK-10dfa458-28
0.300
MAK-UNK-0d6072ac-22
0.300
MAK-UNK-0d6072ac-31
0.298
MAK-UNK-10dfa458-34
0.293
MAK-UNK-0d6072ac-34
0.293
EVA-UNK-a6bd3264-1
0.292
MAK-UNK-10dfa458-33
0.286
MAK-UNK-0d6072ac-32
0.286
MAK-UNK-10dfa458-37
0.286
MAK-UNK-0d6072ac-2
0.263
MAK-UNK-0d6072ac-13
0.256
MAK-UNK-0d6072ac-23
0.241
MAK-UNK-230cdef2-8
0.240
MAT-POS-fce787c2-3
0.233
MAK-UNK-230cdef2-5
0.228
MAK-UNK-230cdef2-9
0.222
MAK-UNK-230cdef2-3
0.222
TRY-UNI-2eddb1ff-3
0.221
LON-WEI-1908424e-9
0.219
MAK-UNK-230cdef2-10
0.217
MAR-TRE-87acfbcc-79
0.216
MAR-TRE-d3c2bf0e-40
0.214
MAR-TRE-799db12b-100
0.213
JAN-GHE-83b26c96-2
0.209
MAK-UNK-f203cb68-2
0.208
SAM-UNK-2684b532-6
0.207
BRU-CON-67e07230-1
0.207
JAN-GHE-83b26c96-3
0.206
JAG-UCB-cedd89ab-5
0.205
SAM-UNK-2684b532-7
0.205
MAT-POS-ea426761-14
0.204
MAR-TRE-87acfbcc-22
0.202
JAN-GHE-83b26c96-4
0.202
JAN-GHE-83b26c96-5
0.202
TRY-UNI-2eddb1ff-5
0.202
TRY-UNI-2eddb1ff-4
0.202
TRY-UNI-714a760b-18
0.202
JOH-UNI-7a6e29a5-5
0.202
MAK-UNK-f203cb68-17
0.202
MAT-POS-fb82b63d-3
0.202
MAR-TRE-87acfbcc-35
0.200
MAK-UNK-2c1752f0-2
0.200
MAT-POS-281d2ee9-1
0.198
MAT-POS-1f3f1a6f-2
0.198
MAT-POS-fce787c2-8
0.198
JAN-GHE-83b26c96-6
0.198
TRY-UNI-714a760b-15
0.198
MAR-TRE-87acfbcc-95
0.198
MAR-TRE-92684b97-80
0.198
UNK-UNK-2ede4078-16
0.196
JOH-UNI-0304dea8-2
0.196
BAR-COM-0f94fc3d-46
0.195
MAR-TRE-87acfbcc-25
0.195
MAR-TRE-8190bb11-72
0.195
MAR-TRE-87acfbcc-50
0.195
MAR-TRE-87acfbcc-36
0.195
MAR-TRE-87acfbcc-41
0.195
PET-UNK-6da3dcd8-3
0.195
MAK-UNK-230cdef2-2
0.194
MAK-UNK-f203cb68-21
0.194
MAK-UNK-230cdef2-4
0.194
MAR-TRE-c8530538-76
0.194
MAT-POS-1f3f1a6f-1
0.194
SAM-UNK-2684b532-5
0.194
EDJ-MED-8698005e-1
0.193
PET-UNK-407a74a5-14
0.193
MAR-TRE-67513f76-71
0.193