Molecular Properties | |
SMILES: | C[C@H](C(=O)O)c1cnc2c(c1)[nH]c1ccc(Cl)nc12 |
MW: | 275.695 |
Fraction sp3: | 0.15 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 78.87 |
cLogP: | 2.9526 |
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-9
0.514
MAK-UNK-0d6072ac-12
0.507
MAK-UNK-0d6072ac-38
0.452
MAK-UNK-0d6072ac-37
0.395
MAK-UNK-0d6072ac-28
0.385
MAK-UNK-0d6072ac-29
0.380
MAK-UNK-0d6072ac-7
0.377
MAK-UNK-0d6072ac-30
0.325
MAK-UNK-0d6072ac-31
0.313
MAK-UNK-0d6072ac-27
0.312
MAK-UNK-0d6072ac-21
0.309
ALP-POS-4f3627cc-1
0.309
MAK-UNK-0d6072ac-8
0.309
MAK-UNK-0d6072ac-33
0.309
AAR-POS-fca48359-19
0.304
MAK-UNK-0d6072ac-3
0.304
GER-UNI-ec786817-1
0.304
AAR-POS-fca48359-20
0.304
MAK-UNK-0d6072ac-4
0.304
MAK-UNK-0d6072ac-18
0.300
MAK-UNK-0d6072ac-16
0.300
MAK-UNK-0d6072ac-11
0.296
MAK-UNK-0d6072ac-17
0.293
MAK-UNK-0d6072ac-34
0.293
MAK-UNK-0d6072ac-36
0.289
MAK-UNK-0d6072ac-32
0.286
MAK-UNK-0d6072ac-1
0.272
MAK-UNK-0d6072ac-20
0.268
MAK-UNK-0d6072ac-10
0.262
EVA-UNK-a6bd3264-1
0.257
MAK-UNK-0d6072ac-22
0.253
MAR-TRE-87acfbcc-79
0.250
AAR-POS-fca48359-18
0.244
MAK-UNK-0d6072ac-19
0.244
MAK-UNK-0d6072ac-14
0.241
MAK-UNK-10dfa458-34
0.233
MAK-UNK-0d6072ac-24
0.233
MAK-UNK-0d6072ac-25
0.233
MAK-UNK-0d6072ac-26
0.229
MAR-TRE-87acfbcc-35
0.229
MAR-TRE-87acfbcc-36
0.227
MAK-UNK-0d6072ac-5
0.226
MAR-TRE-87acfbcc-95
0.226
MAR-TRE-87acfbcc-50
0.225
MAR-TRE-87acfbcc-38
0.224
MAK-UNK-10dfa458-28
0.224
TRY-UNI-2eddb1ff-3
0.221
MAK-UNK-9955b1f3-10
0.219
MAR-TRE-87acfbcc-7
0.218
MAK-UNK-2c1752f0-2
0.217
MAK-UNK-0d6072ac-2
0.217
MAK-UNK-230cdef2-5
0.216
MAR-TRE-87acfbcc-47
0.215
JOH-UNI-7a6e29a5-5
0.215
MAK-UNK-10dfa458-37
0.213
JOH-UNI-6fc75a7c-2
0.213
MAK-UNK-10dfa458-33
0.213
MAK-UNK-0d6072ac-13
0.212
JOH-UNI-f0df842c-1
0.211
MAR-TRE-87acfbcc-41
0.211
MAR-TRE-87acfbcc-25
0.209
JOH-UNI-0304dea8-2
0.209
MAR-TRE-87acfbcc-69
0.208
MAK-UNK-230cdef2-10
0.206
MAR-TRE-87acfbcc-91
0.205
MAR-TRE-87acfbcc-92
0.205
MAR-TRE-87acfbcc-77
0.205
MAR-TRE-e82e6c98-46
0.204
BEN-DND-93268d01-1
0.203
BEN-DND-03406596-12
0.203
MAR-TRE-87acfbcc-15
0.203
BEN-DND-03406596-4
0.203
MAR-TRE-87acfbcc-20
0.203
BEN-DND-03406596-11
0.203
MAR-TRE-87acfbcc-22
0.202
MAR-TRE-f5c2d31c-67
0.202
MAK-UNK-230cdef2-8
0.202
MAR-TRE-799db12b-100
0.200
MAR-TRE-8190bb11-59
0.200
MUS-SCH-c2f96c06-1
0.198
CLI-TLC-0b41e95c-1
0.198
JAN-GHE-83b26c96-7
0.198
JAN-GHE-83b26c96-6
0.198
NAU-LAT-356bd3c2-3
0.198
MAR-TRE-92684b97-80
0.198
MAK-UNK-f983951f-10
0.198
MAR-TRE-d3c2bf0e-40
0.197
LUK-UNK-17c446f9-1
0.196
MAK-UNK-f203cb68-2
0.196
MAR-TRE-799db12b-61
0.195
MAR-TRE-e82e6c98-20
0.195
MAR-TRE-87acfbcc-21
0.195
DAR-DIA-5a24bef0-15
0.194
DAR-DIA-5a24bef0-14
0.194
DAR-DIA-5a24bef0-16
0.194
RYA-MOD-343ecd80-2
0.194
MAR-TRE-87acfbcc-83
0.193
MAR-TRE-f6f5f473-28
0.193
MAR-TRE-87acfbcc-6
0.193
MAR-TRE-87acfbcc-16
0.193