EcoDrugPlus


Synonyms	Anamorelin RC-1291 ST-1291
Status
Molecule Category	Free-form
UNII	DD5RBA1NKF
EPA CompTox	DTXSID20179702

Synonyms

Anamorelin

RC-1291

ST-1291

Status

Molecule Category

Free-form

UNII

DD5RBA1NKF

EPA CompTox

DTXSID20179702


InChI Key	VQPFSIRUEPQQPP-MXBOTTGLSA-N
Smiles	CN(C)N(C)C(=O)[C@@]1(Cc2ccccc2)CCCN(C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)C1
InChI	InChI=1S/C31H42N6O3/c1-30(2,32)28(39)34-26(18-23-20-33-25-15-10-9-14-24(23)25)27(38)37-17-11-16-31(21-37,29(40)36(5)35(3)4)19-22-12-7-6-8-13-22/h6-10,12-15,20,26,33H,11,16-19,21,32H2,1-5H3,(H,34,39)/t26-,31-/m1/s1

InChI Key

VQPFSIRUEPQQPP-MXBOTTGLSA-N

Smiles

CN(C)N(C)C(=O)[C@@]1(Cc2ccccc2)CCCN(C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)C1

InChI

InChI=1S/C31H42N6O3/c1-30(2,32)28(39)34-26(18-23-20-33-25-15-10-9-14-24(23)25)27(38)37-17-11-16-31(21-37,29(40)36(5)35(3)4)19-22-12-7-6-8-13-22/h6-10,12-15,20,26,33H,11,16-19,21,32H2,1-5H3,(H,34,39)/t26-,31-/m1/s1

Property Name	Value
Molecular Formula	C31H42N6O3
Molecular Weight	546.72
AlogP	2.72
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	9.0
Polar Surface Area	114.77
Molecular species	NEUTRAL
Aromatic Rings	3.0
Heavy Atoms	40.0

Property Name

Value

Molecular Formula

C31H42N6O3

Molecular Weight

546.72

AlogP

2.72

Hydrogen Bond Acceptor

5.0

Hydrogen Bond Donor

3.0

Number of Rotational Bond

9.0

Polar Surface Area

114.77

Molecular species

NEUTRAL

Aromatic Rings

3.0

Heavy Atoms

40.0

Resources	Reference
ChEMBL	CHEMBL2110579
DrugBank	DB06645
FDA SRS	DD5RBA1NKF
PubChem	9828911
SureChEMBL	SCHEMBL935751
ZINC	ZINC000043130908

Resources

Reference

ChEMBL

DrugBank

FDA SRS

PubChem

SureChEMBL

ZINC

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

ANAMORELIN

Structure

Physicochemical Descriptors

Cross References