SF-0166
2-amino-2-methylpropan-1-ol;(3S)-3-[6-(difluoromethoxy)-3-pyridinyl]-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid
Molecular Identity
SF-0166
2-amino-2-methylpropan-1-ol;(3S)-3-[6-(difluoromethoxy)-3-pyridinyl]-3-[2-oxo-3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]imidazolidin-1-yl]propanoic acid
PubChem CID: 139593519
2D Structure
Properties
C27H38F2N6O5
Molecular Formula
564.60
Molecular Weight
g/mol
564.2872
Exact Mass
Da
154
TPSA
May have limited oral absorption
4
H-Bond Donors
11
H-Bond Acceptors
745
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)(CO)N.C1CC2=C(NC1)N=C(C=C2)CCCN3CCN(C3=O)C(CC(=O)O)C4=CN=C(C=C4)OC(F)FIsomeric SMILES
SMILES: CC(C)(CO)N.C1CC2=C(NC1)N=C(C=C2)CCCN3CCN(C3=O)[C@@H](CC(=O)O)C4=CN=C(C=C4)OC(F)FSynonyms(9)
SF-016607GC9H6E6F1-HYDROXY-2-METHYLPROPAN-2-AMINIUM (S)-3-(6-(DIFLUOROMETHOXY)PYRIDIN-3-YL)-3-(OXO-2-3-(3-(5,6,7,8-TETRAHYDRO-1,8-NAPHTHYRIDIN-2-YL)PROPYL)IMIDAZOLIDIN-1-YL)PROPANOATERefChem:202982Nesvategrast isobutanolammoniumOTT166OTT-166CHEMBL5314963SCHEMBL30634891
Data from PubChem (NCBI)
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