Bioactive Compound Details

BioIDbio88662
NameIPAMORELIN
ChEMBL IDCHEMBL58547
Molecular FormulaC38H49N9O5
Molecular Weight711.87
Molecular Weight (Monoisotopic)711.3857
TypeProtein
Max PhasePhase 2
Target IDTar101
Target NameNone
SynonymsAIB-HIS-D-2-NAL-D-PHE-LYS-NH2|IPAMORELIN|IPAMORELINA|IPAMORELINE|NNC 26-0161|NNC-26-0161|NNC-260161
SmilesCC(C)(N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O
InchiInChI=1S/C38H49N9O5/c1-38(2,41)37(52)47-32(21-28-22-42-23-43-28)36(51)46-31(20-25-15-16-26-12-6-7-13-27(26)18-25)35(50)45-30(19-24-10-4-3-5-11-24)34(49)44-29(33(40)48)14-8-9-17-39/h3-7,10-13,15-16,18,22-23,29-32H,8-9,14,17,19-21,39,41H2,1-2H3,(H2,40,48)(H,42,43)(H,44,49)(H,45,50)(H,46,51)(H,47,52)/t29-,30+,31+,32-/m0/s1
Inchi KeyNEHWBYHLYZGBNO-BVEPWEIPSA-N
Molecular SpeciesBASE
Targets7.0
Bioactivities22.0
Np Likeness Score0.0
Records Key['Ipamorelin', '4', '1', 'IPAMORELIN', 'SID50112591', 'IPAMORELIN']
Records Name['(S)-6-Amino-2-((R)-2-{(R)-2-[(S)-2-(2-amino-2-methyl-propionylamino)-3-(1H-imidazol-4-yl)-propionylamino]-3-naphthalen-2-yl-propionylamino}-3-phenyl-propionylamino)-hexanoic acid amide', '(S)-6-Amino-2-((R)-2-{(R)-2-[(S)-2-(2-amino-2-methyl-propionylamino)-3-(1H-imidazol-4-yl)-propionylamino]-3-naphthalen-2-yl-propionylamino}-3-phenyl-propionylamino)-hexanoic acid amide', '(S)-6-Amino-2-((R)-2-{(R)-2-[(S)-2-(2-amino-2-methyl-propionylamino)-3-(3H-imidazol-4-yl)-propionylamino]-3-naphthalen-2-yl-propionylamino}-3-phenyl-propionylamino)-hexanoic acid amide', 'IPAMORELIN', 'SID50112591', 'IPAMORELIN']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure