Molecular Properties | |
SMILES: | CC(C(=O)Nc1cnccc1Cl)c1cccc(Cl)c1 |
MW: | 294.03 |
Fraction sp3: | 0.14 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 41.99 |
cLogP: | 4.13 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
4-halopyridine
JAN-GHE-83b26c96-4
0.698
TRY-UNI-2eddb1ff-5
0.698
TRY-UNI-2eddb1ff-4
0.698
JAN-GHE-83b26c96-5
0.698
TRY-UNI-714a760b-18
0.698
SAM-UNK-2684b532-5
0.682
JAN-GHE-83b26c96-2
0.667
SAM-UNK-2684b532-6
0.657
JAN-GHE-83b26c96-3
0.625
MAK-UNK-f203cb68-2
0.611
JAN-GHE-83b26c96-6
0.603
TRY-UNI-714a760b-15
0.580
MAK-UNK-f203cb68-13
0.577
MAK-UNK-f203cb68-12
0.562
MAK-UNK-f203cb68-4
0.557
MAK-UNK-f203cb68-21
0.557
RYA-UNI-9b5114df-1
0.554
MAK-UNK-f203cb68-22
0.550
MAK-UNK-f203cb68-19
0.532
MAK-UNK-f203cb68-11
0.524
SAM-UNK-2684b532-13
0.500
ALP-POS-95b75b4d-8
0.500
MAK-UNK-f203cb68-20
0.500
MAT-POS-1e5f28a7-1
0.500
CHR-SOS-7098f804-21
0.493
JAN-GHE-83b26c96-9
0.479
JAN-GHE-83b26c96-10
0.467
EDG-MED-0da5ad92-5
0.459
TRY-UNI-714a760b-22
0.442
BRU-CON-67e07230-1
0.442
TRY-UNI-2eddb1ff-3
0.438
DAR-DIA-0cde14eb-12
0.438
DAR-DIA-0cde14eb-11
0.438
MAK-UNK-f203cb68-10
0.435
JAN-GHE-83b26c96-7
0.434
MAK-UNK-f203cb68-3
0.432
MAK-UNK-f203cb68-17
0.430
SAM-UNK-2684b532-1
0.430
JAN-GHE-83b26c96-8
0.430
DAR-DIA-0cde14eb-10
0.425
DAR-DIA-0cde14eb-13
0.420
TRY-UNI-9f475305-3
0.417
SAM-UNK-2684b532-3
0.417
BEN-DND-93268d01-15
0.408
TRY-UNI-714a760b-17
0.408
AHN-SAT-202241f6-1
0.408
RYA-UNI-f0c985f9-1
0.405
DAR-DIA-0cde14eb-15
0.405
MAT-POS-bb423b95-5
0.403
MAK-UNK-f203cb68-8
0.400
NAU-LAT-a5c7d7cb-3
0.400
VLA-UCB-05e51b3f-2
0.400
CHR-SOS-7098f804-10
0.397
ADA-UCB-6c2cb422-9
0.396
MAK-UNK-f203cb68-16
0.395
MAK-UNK-f203cb68-1
0.386
VLA-UNK-9a7dc93f-7
0.386
MAK-UNK-f203cb68-7
0.375
TRY-UNI-714a760b-12
0.373
JAG-UCB-cedd89ab-8
0.373
TRY-UNI-2eddb1ff-8
0.371
MAT-POS-fce787c2-3
0.370
JAG-UCB-cedd89ab-5
0.370
MAK-UNK-ffc90da7-7
0.370
BEN-DND-6de5dfa0-19
0.368
TRY-UNI-714a760b-6
0.368
JIN-POS-6dc588a4-4
0.367
JIN-POS-6dc588a4-3
0.367
SAM-UNK-2684b532-12
0.367
TRY-UNI-714a760b-21
0.361
JAN-GHE-83b26c96-22
0.359
EDG-MED-0da5ad92-10
0.359
MAK-UNK-f203cb68-15
0.357
WIL-MOD-03b86a88-3
0.357
EDJ-MED-cf4b0d25-4
0.356
ALP-POS-95b75b4d-6
0.355
ALP-POS-0c2c77e1-1
0.354
JIN-POS-6dc588a4-6
0.354
MAT-POS-bb423b95-3
0.354
ALP-POS-ddb41b15-1
0.354
ADA-UNI-f8e79267-10
0.353
DAR-DIA-0cde14eb-41
0.352
DAR-DIA-0cde14eb-42
0.352
MAK-UNK-6ca90168-24
0.351
JAN-GHE-83b26c96-1
0.350
SAM-UNK-2684b532-11
0.350
ALP-POS-f13221e1-4
0.350
RUB-POS-1325a9ea-19
0.350
DAR-DIA-0cde14eb-57
0.348
DAR-DIA-0cde14eb-56
0.348
EDG-MED-0da5ad92-3
0.346
EDG-MED-0da5ad92-19
0.346
ALP-POS-95b75b4d-7
0.346
BAR-COM-0f94fc3d-19
0.346
ALP-POS-ddb41b15-7
0.345
ADA-UNI-f8e79267-11
0.345
BEN-DND-93268d01-16
0.342
MAK-UNK-f203cb68-18
0.342
ANN-UNI-98d2bf15-3
0.342
JOH-UNI-abfda500-5
0.342