Molecular Properties | |
SMILES: | C[C@H](C(=O)O)c1ccc2c(c1)[nH]c1cnc(Cl)cc12 |
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-4
0.585
AAR-POS-fca48359-20
0.585
AAR-POS-fca48359-19
0.585
GER-UNI-ec786817-1
0.585
MAK-UNK-0d6072ac-3
0.585
MAK-UNK-0d6072ac-16
0.552
MAK-UNK-0d6072ac-27
0.544
MAK-UNK-0d6072ac-8
0.536
MAK-UNK-0d6072ac-1
0.515
MAK-UNK-0d6072ac-28
0.500
MAK-UNK-0d6072ac-29
0.493
MAK-UNK-0d6072ac-9
0.472
MAK-UNK-0d6072ac-17
0.452
MAK-UNK-0d6072ac-30
0.452
MAK-UNK-0d6072ac-14
0.451
MAK-UNK-0d6072ac-18
0.444
MAK-UNK-0d6072ac-25
0.432
MAK-UNK-0d6072ac-24
0.432
MAK-UNK-0d6072ac-5
0.431
MAK-UNK-0d6072ac-12
0.390
MAK-UNK-0d6072ac-26
0.378
MAK-UNK-0d6072ac-19
0.378
AAR-POS-fca48359-18
0.378
MAK-UNK-0d6072ac-35
0.377
MAK-UNK-10dfa458-28
0.368
MAK-UNK-0d6072ac-38
0.359
MAK-UNK-0d6072ac-11
0.346
MAK-UNK-0d6072ac-32
0.333
MAK-UNK-0d6072ac-31
0.329
MAK-UNK-10dfa458-34
0.325
MAK-UNK-0d6072ac-10
0.325
MAK-UNK-0d6072ac-21
0.325
ALP-POS-4f3627cc-1
0.325
MAK-UNK-0d6072ac-36
0.321
MAK-UNK-10dfa458-33
0.317
MAK-UNK-10dfa458-37
0.317
MAK-UNK-0d6072ac-22
0.300
MAK-UNK-0d6072ac-2
0.295
MAK-UNK-0d6072ac-33
0.293
MAK-UNK-0d6072ac-34
0.293
MAK-UNK-0d6072ac-37
0.293
MAK-UNK-0d6072ac-20
0.284
MAK-UNK-0d6072ac-23
0.272
MAK-UNK-0d6072ac-13
0.272
EVA-UNK-a6bd3264-1
0.257
MAR-TRE-87acfbcc-79
0.250
MAR-TRE-87acfbcc-22
0.247
MAR-TRE-87acfbcc-35
0.244
MAR-TRE-87acfbcc-36
0.243
MAR-TRE-87acfbcc-21
0.241
MAR-TRE-87acfbcc-38
0.240
JAN-GHE-83b26c96-2
0.236
MAR-TRE-87acfbcc-7
0.234
MAR-TRE-87acfbcc-20
0.234
MAT-POS-fce787c2-3
0.233
MAR-TRE-87acfbcc-72
0.232
MAR-TRE-87acfbcc-9
0.232
MAR-TRE-87acfbcc-47
0.231
MAR-TRE-87acfbcc-63
0.229
MAR-TRE-87acfbcc-41
0.227
MAR-TRE-92684b97-80
0.226
MAR-TRE-87acfbcc-50
0.225
JAN-GHE-83b26c96-7
0.225
JAN-GHE-83b26c96-6
0.225
MAR-TRE-87acfbcc-25
0.224
MAR-TRE-799db12b-96
0.224
MAR-TRE-87acfbcc-16
0.222
MAK-UNK-f203cb68-2
0.221
MAR-TRE-87acfbcc-91
0.221
SAM-UNK-2684b532-6
0.220
MAK-UNK-9955b1f3-10
0.219
JAN-GHE-83b26c96-3
0.219
SAM-UNK-2684b532-7
0.218
MAR-TRE-87acfbcc-15
0.218
MAK-UNK-f203cb68-21
0.218
MAK-UNK-2c1752f0-2
0.217
MAR-TRE-87acfbcc-67
0.217
MAR-TRE-87acfbcc-87
0.217
MAK-UNK-9955b1f3-13
0.216
SID-ELM-8b394441-14
0.216
TRY-UNI-2eddb1ff-4
0.216
TRY-UNI-2eddb1ff-5
0.216
JAN-GHE-83b26c96-4
0.216
JAN-GHE-83b26c96-5
0.216
TRY-UNI-714a760b-18
0.216
MAK-UNK-230cdef2-5
0.216
MAK-UNK-f203cb68-17
0.215
MAR-TRE-d3c2bf0e-22
0.214
MAK-UNK-230cdef2-8
0.214
BAR-COM-0f94fc3d-55
0.214
MAR-TRE-8190bb11-59
0.214
MAR-TRE-799db12b-100
0.213
MAR-TRE-c8530538-72
0.212
MAR-TRE-87acfbcc-95
0.212
TRY-UNI-714a760b-15
0.211
MAK-UNK-230cdef2-3
0.211
MAR-TRE-92684b97-32
0.211
MAR-TRE-799db12b-61
0.209
MAR-TRE-8190bb11-54
0.209
MAR-TRE-92684b97-91
0.209