Relamorelina
4-[[(2S)-2-[[(2R)-2-[[(2R)-3-(1-benzothiophen-3-yl)-2-(piperidine-4-carbonylamino)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]amino]piperidine-4-carboxamide
Molecular Identity
Relamorelina
4-[[(2S)-2-[[(2R)-2-[[(2R)-3-(1-benzothiophen-3-yl)-2-(piperidine-4-carbonylamino)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-phenylpropanoyl]amino]piperidine-4-carboxamide
PubChem CID: 44251769
2D Structure
Properties
C43H50N8O5S
Molecular Formula
791.00
Molecular Weight
g/mol
790.3625
Exact Mass
Da
3.6
XLogP
Drug-like (Lipinski: < 5)
228
TPSA
May have limited oral absorption
8
H-Bond Donors
8
H-Bond Acceptors
1400
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
RelamorelinaRelamorelineBIM28131BIM-28131DTXSID7010324074-Piperidinecarboxamide, 3-benzo(b)thien-3-yl-N-(4-piperidinylcarbonyl)-D-alanyl-D-tryptophyl-L-phenylalanyl-4-amino-relamorelinumRefChem:879219DTXCID2015174124-((2S)-2-((2R)-2-((2R)-3-(1-benzothiophen-3-yl)-2-((piperidin-4-yl)formamido)propanamido)-3-(1H-indol-3-yl)propanamido)-3-phenylpropanamido)piperidine-4-carboxamide661472-41-9BIW199E18VRelamorelinN-((R)-3-(Benzo[b]thiophen-3-yl)-1-(((R)-1-(((S)-1-((4-carbamoylpiperidin-4-yl)amino)-1-oxo-3-phenylpropan-2-yl)amino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl)amino)-1-oxopropan-2-yl)piperidine-4-carboxamideRELAMORELIN [USAN]
Data from PubChem (NCBI)
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