PDB CCD ID: | 1Y2 |
Number of entries in BioLiP: | 0 |
Chemical formula: | C8 H13 F2 N O2 |
InChI: | InChI=1S/C8H13F2NO2/c9-8(10)3-1-5(2-4-8)6(11)7(12)13/h5-6H,1-4,11H2,(H,12,13)/t6-/m0/s1 |
InChIKey: | HOACGGSRPGHQFC-LURJTMIESA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | N[C@@H](C1CCC(F)(F)CC1)C(O)=O | ACDLabs 12.01 | FC1(F)CCC(C(C(=O)O)N)CC1 | OpenEye OEToolkits 1.7.6 | C1CC(CCC1[C@@H](C(=O)O)N)(F)F | OpenEye OEToolkits 1.7.6 | C1CC(CCC1C(C(=O)O)N)(F)F | CACTVS 3.385 | N[CH](C1CCC(F)(F)CC1)C(O)=O |
|
Name: | (2S)-amino(4,4-difluorocyclohexyl)ethanoic acid |
ZINC: | ZINC000039928053 |