3-[(1S)-1-carboxy-2-cyclopropylethoxy]-2-hydroxybenzoic acid
3-[(1S)-1-carboxy-2-cyclopropylethoxy]-2-hydroxybenzoic acid
Molecular Identity
3-[(1S)-1-carboxy-2-cyclopropylethoxy]-2-hydroxybenzoic acid
3-[(1S)-1-carboxy-2-cyclopropylethoxy]-2-hydroxybenzoic acid
PubChem CID: 56955946
2D Structure
Properties
C13H14O6
Molecular Formula
266.25
Molecular Weight
g/mol
266.0790
Exact Mass
Da
2.7
XLogP
Drug-like (Lipinski: < 5)
104
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
6
H-Bond Acceptors
351
Complexity
SMILES
Canonical SMILES
SMILES: C1CC1CC(C(=O)O)OC2=CC=CC(=C2O)C(=O)OIsomeric SMILES
SMILES: C1CC1C[C@@H](C(=O)O)OC2=CC=CC(=C2O)C(=O)OSynonyms(1)
VCE
Data from PubChem (NCBI)
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Molecular Structure
3-[(1S)-1-carboxy-2-cyclopropylethoxy]-2-hydroxybenzoic acid
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Drug Network
Trials and conditions connected to 3-[(1S)-1-carboxy-2-cyclopropylethoxy]-2-hydroxybenzoic acid
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