Molecule Details
| Molecular Properties | |
| SMILES: | Cc1ccn2cnnc2c1NC(=O)Cc1cccc(Cl)c1 |
| MW: | 300.08 |
| Fraction sp3: | 0.13 |
| HBA: | 4 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 59.29 |
| cLogP: | 2.87 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Order Status | |
| Ordered: | 2020-09-29 |
| Synthesis Location: | enamine |
| Shipped: | synthesis in progress |
JAG-UCB-52b62a6f-1
EDJ-MED-c8e7a002-7
0.600
EDG-MED-0da5ad92-15
0.514
JAG-UCB-a3ef7265-17
0.507
NAU-LAT-e1818702-7
0.507
EDJ-MED-49816e9b-2
0.507
EDG-MED-0da5ad92-18
0.487
EDG-MED-0da5ad92-16
0.467
JAG-UCB-a3ef7265-15
0.447
EDJ-MED-c8e7a002-17
0.446
EDJ-MED-c8e7a002-8
0.446
EDJ-MED-49816e9b-5
0.442
EDJ-MED-49816e9b-3
0.442
JAN-GHE-f4ca5a00-12
0.438
NAU-LAT-e1818702-1
0.438
NAU-LAT-e1818702-9
0.434
EDJ-MED-97c1bf5c-2
0.432
JAG-UCB-52b62a6f-11
0.432
EDG-MED-0da5ad92-13
0.429
PET-UNK-8df914d1-4
0.429
EDJ-MED-97c1bf5c-1
0.427
EDJ-MED-7bb79bc5-1
0.427
JAN-GHE-5a013bed-7
0.427
NAU-LAT-e1818702-10
0.427
EDG-MED-0da5ad92-12
0.423
EDG-MED-0da5ad92-14
0.423
JAN-GHE-5a013bed-11
0.421
TRY-UNI-714a760b-6
0.418
PET-UNK-8df914d1-3
0.418
NAU-LAT-e1818702-8
0.417
JAN-GHE-5a013bed-1
0.416
JAN-GHE-5a013bed-6
0.413
JAN-GHE-5a013bed-5
0.411
EDG-MED-0da5ad92-21
0.410
EDG-MED-0da5ad92-17
0.407
EDJ-MED-50fe53e8-3
0.405
NAU-LAT-a5c7d7cb-11
0.400
ABI-SAT-4d06482b-2
0.395
JAN-GHE-5a013bed-9
0.395
NAU-LAT-8502cac5-7
0.394
NAU-LAT-a5c7d7cb-12
0.393
PET-UNK-e44ffd04-1
0.393
ANN-UNI-98d2bf15-3
0.390
TRY-UNI-714a760b-3
0.390
AGN-NEW-c7b24fe3-5
0.390
JAN-GHE-5a013bed-8
0.385
MIC-UNK-66895286-1
0.385
EDG-MED-0da5ad92-2
0.385
EDJ-MED-50fe53e8-2
0.384
MAT-POS-f7918075-6
0.384
EDJ-MED-50fe53e8-4
0.384
EDJ-MED-c8e7a002-6
0.382
PET-UNK-8df914d1-5
0.381
JAN-GHE-f4ca5a00-16
0.381
JAN-GHE-5a013bed-10
0.380
SAM-UNK-2684b532-13
0.375
ALP-POS-95b75b4d-8
0.375
AGN-NEW-c7b24fe3-4
0.373
PET-UNK-8df914d1-2
0.372
ALP-POS-8b8a49e1-7
0.372
ALP-POS-95b75b4d-6
0.370
EDJ-MED-c8e7a002-5
0.370
AGN-NEW-c7b24fe3-1
0.369
EDJ-MED-50fe53e8-1
0.368
MAT-POS-3cc264b0-1
0.368
SAM-UNK-2684b532-11
0.365
MAT-POS-bb423b95-5
0.365
MAT-POS-199e2e7c-1
0.364
MAT-POS-f7918075-5
0.364
MAT-POS-bb423b95-8
0.364
VLA-UCB-00f2c2b3-7
0.360
ALP-POS-95b75b4d-7
0.360
MAT-POS-bfb445d4-2
0.360
MAT-POS-14ad9fe9-1
0.359
JAN-GHE-5a013bed-4
0.358
EDJ-MED-c8e7a002-12
0.356
MAT-POS-4211dce8-1
0.356
MAT-POS-bb423b95-9
0.356
MAK-UNK-6ca90168-23
0.353
EDJ-MED-c8e7a002-14
0.352
MAT-POS-e1b5ac6b-1
0.352
EDG-MED-0da5ad92-6
0.349
SAM-UNK-2684b532-12
0.349
MAT-POS-bb423b95-2
0.348
EDJ-MED-c8e7a002-1
0.348
EDJ-MED-00c1612e-1
0.348
PET-UNK-8df914d1-1
0.348
EDJ-MED-c8e7a002-11
0.345
ADA-UCB-6c2cb422-1
0.345
MAT-POS-bb423b95-6
0.345
NAU-LAT-a5c7d7cb-10
0.345
JAN-GHE-f4ca5a00-17
0.345
ALP-POS-3b848b35-3
0.345
MIC-UNK-08cd9c58-1
0.344
MAT-POS-f7918075-3
0.344
EDJ-MED-a364e151-1
0.344
EDJ-MED-c8e7a002-2
0.344
EDJ-MED-c8e7a002-15
0.344
EDJ-MED-976da9a6-2
0.344
JAN-GHE-83b26c96-15
0.341
EDG-MED-0da5ad92-1
0.341