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| Ligand Name: (1S,3S)-3-amino-4-(perfluoropropan-2-ylidene)cyclopentane-1-carboxylic acid |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB1106 |
PubChem:
16094601
|
Synonym(s):
- chembl220453
- schembl12689554
- bdbm50199989
- nsc793878
- nsc-793878
- (1s,3s)-3-amino-4-(2,2,2-trifluoro-1-trifluoromethylethylidene)cyclopentane
show 5 synonym(s)
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| DrugBank: - |
ChEMBL: CHEMBL220453 |
| Canonical SMILES: N[C@H]1C[C@H](CC1=C(C(F)(F)F)C(F)(F)F)C(O)=O |
| Standard InChI: InChI=1S/C9H9F6NO2/c10-8(11,12)6(9(13,14)15)4-1-3(7(17)18)2-5(4)16/h3,5H,1-2,16H2,(H,17,18)/t3-,5-/m0/s1 |
| Molecular Formula: C9H9F6NO2 |
Mol. Weight: 277.05374 |
logP: 2.2295 |
| HBD: 2 | HBA: 2 |
| #Rotatable Bonds: 1 | TPSA: 63.32 |