Compound Detail
CHEMBL352928
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N=C(N)NCCC[C@H](NC(=O)[C@@H]1CC[C@H]2CN(C(=O)CCc3ccccc3)CC(=O)N21)C(=O)c1nc2ccccc2s1
Basic Information
| ChEMBL ID | CHEMBL352928 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | ORLJEHHINDEMRP-PMVMPFDFSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
589.7
MW (Da)
2.06
ALogP
7
HBA
4
HBD
161.6
PSA (Ų)
0.12
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 10206546 | 10.1016/s0960-894x(99)00096-7 | Prothrombin | 1 |
| 10206546 | 10.1016/s0960-894x(99)00096-7 | Serine protease 1 | 1 |
| 10206546 | 10.1016/s0960-894x(99)00096-7 | Thrombin & trypsin | 1 |
| 18053726 | 10.1016/j.bmc.2007.11.015 | Prothrombin | 1 |
Data from ChEMBL 36 via Core Engine