Molecule Details
| Molecular Properties | |
| SMILES: | Cc1ccncc1NC(=O)CCc1ccc(F)cc1 |
| MW: | 258.12 |
| Fraction sp3: | 0.2 |
| HBA: | 2 |
| HBD: | 1 |
| Rotatable Bonds: | 4 |
| TPSA: | 41.99 |
| cLogP: | 3.1 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Source | |
| Enamine REAL: | Z1129284972 |
| Enamine Extended REAL: | s_22____3391102____106960 |
| Mcule Ultimate: | CXNSRTJHMXCHKO-UHFFFAOYSA-N |
| MolPort: | MolPort-047-550-786 |
| Order Status | |
| Ordered: | 2020-05-17 |
| Synthesis Location: | enamine |
| Shipped: | 2020-06-16 |
AAR-POS-d2a4d1df-1
BEN-DND-93268d01-6
0.646
ALP-POS-f13221e1-4
0.582
MAT-POS-590ac91e-17
0.578
BEN-DND-93268d01-7
0.567
ALE-HEI-f28a35b5-12
0.541
BEN-DND-93268d01-4
0.537
JAN-GHE-83b26c96-11
0.524
MAK-UNK-6ca90168-26
0.517
PET-SGC-6e7c5dc0-1
0.516
ALP-POS-95b75b4d-1
0.515
TRY-UNI-714a760b-5
0.500
PET-SGC-d0fd10df-1
0.494
PET-SGC-2e937068-1
0.493
ALE-HEI-f28a35b5-10
0.493
EDJ-MED-c9f55a56-1
0.493
MAT-POS-590ac91e-10
0.493
ASH-SAT-43770c7d-9
0.492
MAT-POS-590ac91e-9
0.485
GAB-REV-70cc3ca5-20
0.478
MIH-UNI-6b9ca91a-1
0.478
GAB-REV-70cc3ca5-12
0.474
ANN-UNI-98d2bf15-2
0.472
MAK-UNK-372b0df5-3
0.471
MAT-POS-590ac91e-6
0.470
MAT-POS-590ac91e-11
0.469
PET-SGC-83d43576-1
0.468
VLA-UCB-00f2c2b3-2
0.467
DAR-DIA-0cde14eb-2
0.467
MAK-UNK-6435e6c2-8
0.464
AAR-POS-d2a4d1df-3
0.464
EDG-MED-0da5ad92-8
0.464
TRY-UNI-2eddb1ff-2
0.464
VLA-UCB-00f2c2b3-1
0.461
GAB-REV-70cc3ca5-3
0.459
EDJ-MED-e58735b6-1
0.458
JAN-GHE-83b26c96-13
0.457
TRY-UNI-714a760b-6
0.457
ALP-POS-95b75b4d-2
0.457
EDJ-MED-e58735b6-2
0.457
GAB-REV-70cc3ca5-22
0.457
ALE-HEI-f28a35b5-3
0.456
BAR-COM-0f94fc3d-18
0.455
GAB-REV-70cc3ca5-18
0.455
JAN-GHE-83b26c96-14
0.452
DAR-DIA-0cde14eb-76
0.452
ALP-POS-95b75b4d-3
0.452
JAN-GHE-83b26c96-12
0.451
BEN-DND-93268d01-10
0.449
MAT-POS-590ac91e-24
0.449
DAR-DIA-0cde14eb-63
0.447
DAR-DIA-0cde14eb-62
0.447
MAT-POS-590ac91e-15
0.443
JOH-UNI-abfda500-6
0.443
ANN-UNI-98d2bf15-1
0.443
MAT-POS-590ac91e-7
0.441
DAR-DIA-0cde14eb-79
0.440
MAT-POS-c9973a83-1
0.440
RAL-THA-6b94ceba-6
0.440
BEN-DND-93268d01-13
0.437
EDJ-MED-3c65e9ce-4
0.437
BEN-DND-93268d01-11
0.435
MAT-POS-590ac91e-23
0.435
EDG-MED-0da5ad92-4
0.435
GAB-REV-70cc3ca5-21
0.435
ALE-HEI-f28a35b5-6
0.435
BEN-DND-09b88bf4-5
0.435
TRY-UNI-714a760b-10
0.435
BEN-DND-93268d01-9
0.435
DAR-DIA-0cde14eb-61
0.434
DAR-DIA-0cde14eb-64
0.434
ANN-UNI-98d2bf15-5
0.434
ALP-POS-95b75b4d-4
0.434
DAR-DIA-0cde14eb-1
0.434
TRY-UNI-2eddb1ff-1
0.432
GAB-REV-70cc3ca5-9
0.429
RAL-THA-901e9a10-2
0.429
TRY-UNI-714a760b-20
0.427
MAK-UNK-6ca90168-27
0.426
GAB-REV-70cc3ca5-13
0.425
EDG-MED-0da5ad92-9
0.425
DAN-RED-da448e80-5
0.423
DAR-DIA-0cde14eb-3
0.423
DAR-DIA-0cde14eb-77
0.423
MAK-UNK-372b0df5-2
0.423
DAR-DIA-0cde14eb-4
0.423
EDJ-MED-3c65e9ce-1
0.423
BEN-DND-93268d01-8
0.423
MAT-POS-590ac91e-2
0.422
MAT-POS-590ac91e-1
0.422
ERI-UCB-5b47150d-1
0.422
EDJ-MED-e58735b6-3
0.421
DAR-DIA-0cde14eb-78
0.421
BEN-DND-6de5dfa0-4
0.419
BEN-DND-09b88bf4-4
0.419
MAT-POS-590ac91e-25
0.419
BEN-DND-22e6b372-3
0.419
MAT-POS-f42f3716-4
0.419
RAL-THA-6b94ceba-16
0.418
GAB-REV-70cc3ca5-15
0.418
BEN-DND-09b88bf4-6
0.413