Molecule Details
| Molecular Properties | |
| SMILES: | Cc1ccncc1NC(=O)C1CC(C2CC2)C1 |
| MW: | 230.14 |
| Fraction sp3: | 0.57 |
| HBA: | 2 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 41.99 |
| cLogP: | 2.76 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Source | |
| Enamine REAL: | Z2703873181 |
| MolPort: | MolPort-047-557-707 |
| Order Status | |
| Ordered: | 2020-05-17 |
| Synthesis Location: | enamine |
| Shipped: | 2020-06-16 |
AAR-POS-d2a4d1df-1
DAR-DIA-6a508060-12
0.741
MAT-POS-590ac91e-21
0.574
MAT-POS-590ac91e-26
0.557
MAT-POS-590ac91e-22
0.541
MAT-POS-590ac91e-19
0.533
ERI-UCB-5b47150d-6
0.525
MAT-POS-590ac91e-12
0.516
AAR-POS-d2a4d1df-3
0.510
MAK-UNK-6435e6c2-8
0.510
MAT-POS-590ac91e-8
0.500
MAT-POS-590ac91e-23
0.492
MAK-UNK-6ca90168-27
0.491
MAT-POS-590ac91e-28
0.478
SAD-SAT-7d5528d9-26
0.468
ERI-UCB-5b47150d-4
0.467
MAT-POS-590ac91e-10
0.462
ASH-SAT-43770c7d-9
0.458
MAK-UNK-6ca90168-26
0.456
MAT-POS-590ac91e-7
0.453
TRY-UNI-714a760b-11
0.453
MAT-POS-590ac91e-5
0.453
ALE-HEI-f28a35b5-7
0.453
SAD-SAT-7d5528d9-7
0.449
TRY-UNI-714a760b-10
0.446
ALE-HEI-f28a35b5-6
0.446
EDG-MED-0da5ad92-4
0.446
DAR-DIA-6a508060-6
0.442
BRU-CON-c4e3408a-1
0.442
JAN-GHE-f4ca5a00-13
0.442
MAT-POS-b3e365b9-4
0.442
MAT-POS-b3e365b9-3
0.442
ALE-HEI-f28a35b5-13
0.435
ALE-HEI-f28a35b5-12
0.435
ERI-UCB-5b47150d-1
0.433
MAT-POS-590ac91e-2
0.433
MAT-POS-590ac91e-1
0.433
TRY-UNI-714a760b-16
0.433
ADA-UCB-6c2cb422-2
0.427
NAU-LAT-3f5f3993-2
0.426
EDJ-MED-3c65e9ce-4
0.426
BEN-DND-93268d01-11
0.424
ALE-HEI-f28a35b5-17
0.422
SCO-VAN-260d9628-1
0.422
MAT-POS-590ac91e-14
0.420
MAT-POS-590ac91e-24
0.418
MAT-POS-590ac91e-4
0.418
MAT-POS-590ac91e-6
0.415
EDG-MED-0da5ad92-9
0.414
BEN-DND-6de5dfa0-3
0.414
MAT-POS-590ac91e-29
0.414
NAU-LAT-3f5f3993-5
0.414
BEN-DND-09b88bf4-3
0.414
MAT-POS-590ac91e-13
0.413
MAT-POS-590ac91e-11
0.413
MAT-POS-590ac91e-3
0.412
MAT-POS-590ac91e-15
0.412
MAT-POS-590ac91e-9
0.409
TRY-UNI-714a760b-17
0.409
AHN-SAT-202241f6-1
0.409
MAT-POS-590ac91e-25
0.408
MAK-UNK-372b0df5-1
0.408
TRY-UNI-714a760b-4
0.406
MAT-POS-5d20d11c-1
0.406
MAT-POS-590ac91e-16
0.406
ALE-HEI-f28a35b5-1
0.406
BEN-DND-09b88bf4-5
0.403
BEN-DND-93268d01-9
0.403
SIM-DEM-4fb93ec7-1
0.403
TRY-UNI-714a760b-5
0.400
JAN-GHE-83b26c96-11
0.400
BEN-DND-6de5dfa0-14
0.397
BEN-DND-93268d01-10
0.397
MAT-POS-590ac91e-20
0.397
PET-SGC-6e7c5dc0-1
0.394
IND-SYN-2c708b29-2
0.393
BEN-DND-6de5dfa0-15
0.392
BEN-DND-93268d01-8
0.391
BEN-DND-6de5dfa0-10
0.391
EDJ-MED-3c65e9ce-1
0.391
BEN-DND-22e6b372-3
0.389
ALE-HEI-f28a35b5-2
0.388
BEN-DND-6de5dfa0-12
0.388
ALP-POS-95b75b4d-4
0.387
BEN-DND-93268d01-13
0.386
MAK-UNK-7264f48c-5
0.385
MAT-POS-0d6fb2dd-1
0.384
MAT-POS-6c3d76b3-1
0.384
GAB-REV-70cc3ca5-21
0.382
ABI-SAT-4d06482b-1
0.382
MIH-UNI-6b9ca91a-1
0.382
ALE-HEI-f28a35b5-3
0.382
DAR-DIA-0cde14eb-70
0.382
ALP-POS-95b75b4d-1
0.380
MAT-POS-590ac91e-27
0.380
BEN-DND-22e6b372-4
0.380
MAK-UNK-372b0df5-3
0.380
TRY-UNI-2eddb1ff-3
0.380
BEN-DND-93268d01-3
0.377
ALE-HEI-f28a35b5-10
0.377
EDJ-MED-c9f55a56-1
0.377