Bioactive Compound Details

BioIDbio44528
NameCAPROMORELIN
ChEMBL IDCHEMBL113313
Molecular FormulaC28H35N5O4
Molecular Weight505.62
Molecular Weight (Monoisotopic)505.2689
TypeSmall molecule
Max PhasePhase 2
Target IDTar17
Target NameHormone unspecific (HOM)
SynonymsCAPIMORELIN|CAPROMORELIN|CAPROMORELINA|CAPROMORELINE|CP-424,391|CP-424391|CP-424391-18|Capromorelin
SmilesCN1N=C2CCN(C(=O)[C@@H](COCc3ccccc3)NC(=O)C(C)(C)N)C[C@@]2(Cc2ccccc2)C1=O
InchiInChI=1S/C28H35N5O4/c1-27(2,29)25(35)30-22(18-37-17-21-12-8-5-9-13-21)24(34)33-15-14-23-28(19-33,26(36)32(3)31-23)16-20-10-6-4-7-11-20/h4-13,22H,14-19,29H2,1-3H3,(H,30,35)/t22-,28-/m1/s1
Inchi KeyKVLLHLWBPNCVNR-SKCUWOTOSA-N
Molecular SpeciesNEUTRAL
Targets8.0
Bioactivities21.0
Np Likeness Score-0.38
Records Key['3, (Capromorelin, (CP-424391-18))', 'CAPROMORELIN', 'Capromorelin', 'CAPROMORELIN', '3', 'CAPROMORELIN', 'COVC-1213984969', '108', 'CP 424 391-18']
Records Name['2-Amino-N-[(R)-2-((R)-3a-benzyl-2-methyl-3-oxo-2,3,3a,4,6,7-hexahydro-pyrazolo[4,3-c]pyridin-5-yl)-1-benzyloxymethyl-2-oxo-ethyl]-2-methyl-propionamide', 'CAPROMORELIN', 'Capromorelin', 'CAPROMORELIN', '2-Amino-N-[(R)-2-((R)-3a-benzyl-2-methyl-3-oxo-2,3,3a,4,6,7-hexahydro-pyrazolo[4,3-c]pyridin-5-yl)-1-benzyloxymethyl-2-oxo-ethyl]-2-methyl-propionamide', 'CAPROMORELIN', 'CAPROMORELIN', 'Capromorelin', 'Capromorelin']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure