Molecular Properties | |
SMILES: | O=C(Nc1ccccc1)Nc1c(F)ncn2nccc12 |
MW: | 271.255 |
Fraction sp3: | 0.0 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 71.32 |
cLogP: | 2.5124 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
α-Halogen substituted N-heterocycles
4-halopyridine
2-halopyridine
SID-ELM-8b394441-11
0.636
SID-ELM-b654bfa2-12
0.507
SID-ELM-2583a2cd-22
0.472
SID-ELM-b654bfa2-7
0.440
SID-ELM-b654bfa2-4
0.434
SID-ELM-8b394441-1
0.426
SID-ELM-b654bfa2-22
0.410
SID-ELM-b654bfa2-19
0.408
SID-ELM-b654bfa2-17
0.397
SID-ELM-b654bfa2-18
0.397
SID-ELM-b654bfa2-1
0.397
AAR-POS-d2a4d1df-11
0.379
SID-ELM-b654bfa2-6
0.372
SID-ELM-b654bfa2-2
0.355
WAR-XCH-79d12f6e-3
0.352
SID-ELM-b654bfa2-3
0.351
SID-ELM-8b394441-15
0.350
SID-ELM-8b394441-3
0.347
SID-ELM-8b394441-9
0.346
SID-ELM-8b394441-12
0.346
SID-ELM-2583a2cd-5
0.338
HAN-NEW-5f56c3bc-1
0.338
SID-ELM-8b394441-13
0.338
SID-ELM-8b394441-14
0.333
TRY-UNI-714a760b-8
0.333
SID-ELM-8b394441-10
0.329
SID-ELM-8b394441-5
0.329
SID-ELM-8b394441-22
0.326
SID-ELM-8b394441-8
0.325
WIL-UNI-5578df48-12
0.325
SID-ELM-2583a2cd-14
0.325
TRY-UNI-714a760b-4
0.324
ALE-HEI-f28a35b5-1
0.324
MAX-MCD-16e3709a-1
0.323
SID-ELM-2583a2cd-6
0.315
SID-ELM-2583a2cd-11
0.309
SID-ELM-2583a2cd-7
0.307
SID-ELM-2583a2cd-20
0.305
MAK-UNK-129dcd6f-6
0.304
WIL-UNI-5578df48-10
0.304
SID-ELM-8b394441-6
0.304
WAR-XCH-79d12f6e-10
0.301
WAR-XCH-b0339bbe-20
0.301
AAR-UNI-c25c2f1e-79
0.300
MAK-UNK-129dcd6f-8
0.299
SID-ELM-8b394441-7
0.296
WIL-UNI-5578df48-11
0.293
SID-ELM-2583a2cd-17
0.293
ROD-LAS-d5538ff9-9
0.291
MAK-UNK-ae34c249-3
0.290
GIA-UNK-3f36037a-7
0.290
MAK-UNK-30aad1f1-17
0.289
SID-ELM-2583a2cd-9
0.289
MAK-UNK-129dcd6f-1
0.289
AAR-UNI-c25c2f1e-51
0.287
WIL-UNI-5578df48-9
0.287
MAK-UNK-129dcd6f-17
0.284
PET-SGC-0f1d26ed-1
0.282
WIL-UNI-5578df48-7
0.280
BEN-DND-031a96cc-8
0.280
SID-ELM-2583a2cd-10
0.277
SID-ELM-2583a2cd-8
0.277
AAR-UNI-c25c2f1e-46
0.275
AAR-UNI-c25c2f1e-64
0.275
WIL-UNI-5578df48-6
0.273
GIA-UNK-3f36037a-2
0.273
MAK-UNK-129dcd6f-15
0.273
MAK-UNK-30aad1f1-15
0.272
MAK-UNK-30aad1f1-9
0.272
MAK-UNK-129dcd6f-18
0.272
AAR-UNI-c25c2f1e-31
0.271
MAK-UNK-30aad1f1-16
0.270
MAK-UNK-ae34c249-4
0.269
MAK-UNK-129dcd6f-7
0.267
SAD-SAT-2fd372d1-8
0.267
DAR-DIA-03336633-1
0.265
HAN-NEW-5f56c3bc-3
0.265
AAR-UNI-c25c2f1e-16
0.265
AAR-UNI-c25c2f1e-30
0.265
CAS-DEP-e179b1f5-2
0.264
MAK-UNK-30aad1f1-2
0.264
MAK-UNK-30aad1f1-3
0.264
MAK-UNK-129dcd6f-16
0.264
WES-WAB-2b40d25a-1
0.263
AAR-POS-0daf6b7e-32
0.263
AAR-UNI-c25c2f1e-100
0.262
AAR-UNI-c25c2f1e-40
0.262
PET-SGC-0f1d26ed-2
0.262
DAR-DIA-fc970077-14
0.262
SAD-SAT-6b5a89f0-8
0.262
WIL-UNI-5578df48-13
0.261
MAK-UNK-30aad1f1-4
0.260
AAR-POS-0daf6b7e-44
0.260
MAR-TRE-1c920f6f-42
0.259
AAR-UNI-c25c2f1e-65
0.259
SAD-SAT-689b7d5a-4
0.259
AAR-UNI-c25c2f1e-78
0.259
WIL-UNI-5578df48-20
0.258
UNK-UNK-2ede4078-49
0.258
DAR-DIA-03336633-11
0.258