CHEMBL564010
(3S,14R,16S)-16-[(1R)-1-hydroxy-2-[(3-propan-2-ylphenyl)methylamino]ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione
Molecular Identity
CHEMBL564010
(3S,14R,16S)-16-[(1R)-1-hydroxy-2-[(3-propan-2-ylphenyl)methylamino]ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione
PubChem CID: 25163982
2D Structure
Properties
C29H49N3O3
Molecular Formula
487.70
Molecular Weight
g/mol
487.3774
Exact Mass
Da
5.6
XLogP
Above Lipinski threshold
81.7
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
626
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(10)
CHEMBL564010(3S,14R,16S)-16-[(1R)-1-hydroxy-2-{[3-(1-methylethyl)benzyl]amino}ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione(3S,14R,16S)-16-[(1R)-1-hydroxy-2-{[3-(1-methylethyl)benzyl]amino}ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5- dioneBAVSCHEMBL3196431BDBM50294219PD129834Q27458291(3S,14R,16S)-16-((R)-1-hydroxy-2-(3-isopropylbenzylamino)ethyl)-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-dione(3S,14R,16S)-16-[(1R)-1-hydroxy-2-{[3-(1-methylethyl)benzyl]amino}ethyl]-3,4,14-trimethyl-1,4-diazacyclohexadecane-2,5-
Data from PubChem (NCBI)
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