Molecule Details
| Molecular Properties | |
| SMILES: | Cc1ncccc1NC(=O)Cc1cccc(Cl)c1 |
| MW: | 260.07 |
| Fraction sp3: | 0.14 |
| HBA: | 2 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 41.99 |
| cLogP: | 3.22 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Source | |
| Enamine REAL: | Z1303530476 |
| Enamine Extended REAL: | s_22____6391392____3020518 |
| Mcule: | MCULE-5141198828 |
| Order Status | |
| Ordered: | 2020-05-17 |
| Synthesis Location: | enamine |
| Shipped: | 2020-05-26 |
AAR-POS-d2a4d1df-11
AGN-NEW-c7b24fe3-4
0.609
AGN-NEW-c7b24fe3-5
0.609
AGN-NEW-c7b24fe3-1
0.600
EDJ-MED-49816e9b-2
0.597
ABI-SAT-4d06482b-2
0.594
TRY-UNI-714a760b-6
0.554
EDG-MED-0da5ad92-16
0.547
EDG-MED-0da5ad92-21
0.547
EDG-MED-0da5ad92-17
0.537
PET-UNK-8df914d1-3
0.530
SAM-UNK-2684b532-13
0.523
ALP-POS-95b75b4d-8
0.523
EDG-MED-0da5ad92-13
0.523
MAT-POS-bb423b95-5
0.522
ALP-POS-95b75b4d-6
0.515
TRY-UNI-714a760b-3
0.515
MAT-POS-bb423b95-2
0.514
JAN-GHE-5a013bed-10
0.508
MAT-POS-f7918075-3
0.507
MIC-UNK-08cd9c58-1
0.507
RUB-POS-1325a9ea-8
0.507
MIC-UNK-d935700b-1
0.500
JIN-POS-6dc588a4-3
0.500
EDG-MED-0da5ad92-18
0.500
RUB-POS-1325a9ea-19
0.500
ALP-POS-95b75b4d-7
0.493
JOH-UNI-abfda500-5
0.493
ANN-UNI-98d2bf15-3
0.493
JOH-UNI-abfda500-4
0.493
EDJ-MED-49816e9b-5
0.493
JAN-GHE-5a013bed-8
0.492
EDG-MED-0da5ad92-2
0.492
EDJ-MED-c8e7a002-12
0.486
MAK-UNK-6ca90168-23
0.486
EDG-MED-0da5ad92-15
0.485
PET-UNK-158bee2a-2
0.484
MAT-POS-c20a539d-6
0.480
MAT-POS-29385cc1-3
0.480
JIN-POS-6dc588a4-6
0.479
MAT-POS-bb423b95-3
0.479
PET-UNK-e274cad4-6
0.479
ALP-POS-0c2c77e1-1
0.479
SAM-UNK-2684b532-11
0.479
JIN-POS-6dc588a4-4
0.479
SAM-UNK-2684b532-12
0.479
PET-UNK-158bee2a-3
0.478
JAG-UCB-a3ef7265-15
0.478
AGN-NEW-cce853d0-2
0.474
MIC-UNK-50cce87d-3
0.473
RUB-POS-1325a9ea-5
0.473
JIN-POS-6dc588a4-10
0.473
RUB-POS-1325a9ea-3
0.473
VLA-UCB-00f2c2b3-7
0.472
EDJ-MED-49816e9b-3
0.471
EDG-MED-0da5ad92-12
0.471
PET-UNK-158bee2a-4
0.470
JAN-GHE-5a013bed-11
0.470
MIC-UNK-8971c93c-1
0.467
MAT-POS-f7918075-4
0.467
MAT-POS-f7918075-8
0.467
JIN-POS-6dc588a4-23
0.467
JIN-POS-6dc588a4-2
0.466
RUB-POS-1325a9ea-17
0.466
MAT-POS-bb423b95-9
0.466
MAT-POS-bb423b95-4
0.466
ALP-POS-95b75b4d-5
0.466
MAT-POS-bb423b95-1
0.466
MAT-POS-4211dce8-1
0.466
VLA-UNK-411a133b-2
0.463
JAN-GHE-5a013bed-6
0.462
EDJ-MED-c5ca5386-2
0.462
JAN-GHE-5a013bed-9
0.462
MAT-POS-8feb6e35-1
0.462
MAT-POS-14ad9fe9-1
0.462
RUB-POS-1325a9ea-4
0.461
RUB-POS-1325a9ea-13
0.459
RUB-POS-1325a9ea-12
0.459
EDJ-MED-a364e151-3
0.459
EDJ-MED-c8e7a002-14
0.459
PET-UNK-8df914d1-4
0.456
VLA-UNK-411a133b-1
0.456
NAU-LAT-e1818702-7
0.456
JAG-UCB-a3ef7265-17
0.456
PET-UNK-d899bab6-3
0.456
MAT-POS-29385cc1-4
0.455
NAU-LAT-e1818702-10
0.455
JAN-GHE-5a013bed-7
0.455
JIN-POS-6dc588a4-14
0.453
JIN-POS-6dc588a4-24
0.453
RUB-POS-1325a9ea-11
0.453
JIN-POS-6dc588a4-15
0.453
MAT-POS-f7918075-5
0.453
EDJ-MED-076d6e64-1
0.453
MAT-POS-199e2e7c-1
0.453
MAT-POS-bb423b95-8
0.453
EDJ-MED-6e43a462-4
0.453
JOH-UNI-6fede743-1
0.453
EDJ-MED-b24713dc-2
0.452
JOH-UNI-6fede743-3
0.452
ADA-UCB-6c2cb422-1
0.452