macimorelin   Click here for help

GtoPdb Ligand ID: 9745

Synonyms: AEZS-130 | AEZS130 | Aib-DTrp-DgTrp-CHO | EP-1572 | EP1572 | UMV1843
Approved drug
macimorelin is an approved drug (FDA (2017), EMA (2019))
Compound class: Synthetic organic
Comment: Macimorelin is a ghrelin peptidomimetic [2]. It is a growth hormone (GH) secretagogue. The approved drug is the acetate salt (PubChem CID 71526737)- we show the parent molecule in this entry.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 7
Hydrogen bond donors 6
Rotatable bonds 12
Topological polar surface area 144.9
Molecular weight 474.24
XLogP 1.91
No. Lipinski's rules broken 1
SMILES / InChI / InChIKey
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Canonical SMILES O=CNC(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C(N)(C)C)Cc1c[nH]c2c1cccc2
Isomeric SMILES O=CN[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](NC(=O)C(N)(C)C)Cc1c[nH]c2c1cccc2
InChI InChI=1S/C26H30N6O3/c1-26(2,27)25(35)31-22(11-16-13-28-20-9-5-3-7-18(16)20)24(34)32-23(30-15-33)12-17-14-29-21-10-6-4-8-19(17)21/h3-10,13-15,22-23,28-29H,11-12,27H2,1-2H3,(H,30,33)(H,31,35)(H,32,34)/t22-,23-/m1/s1
InChI Key UJVDJAPJQWZRFR-DHIUTWEWSA-N