EcoDrugPlus


Synonyms	AMG 706 Motesanib diphosphate Motesanib phosphate
Status
Molecule Category	Salt-form
UNII	T6Q3060U91
EPA CompTox	DTXSID30235080
Parent Compound:	MOTESANIB

Synonyms

AMG 706

Motesanib diphosphate

Motesanib phosphate

Status

Molecule Category

Salt-form

UNII

T6Q3060U91

EPA CompTox

DTXSID30235080

Parent Compound:

MOTESANIB


InChI Key	ONDPWWDPQDCQNJ-UHFFFAOYSA-N
Smiles	CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc21.O=P(O)(O)O.O=P(O)(O)O
InChI	InChI=1S/C22H23N5O.2H3O4P/c1-22(2)14-26-19-12-16(5-6-18(19)22)27-21(28)17-4-3-9-24-20(17)25-13-15-7-10-23-11-8-15;21-5(2,3)4/h3-12,26H,13-14H2,1-2H3,(H,24,25)(H,27,28);2(H3,1,2,3,4)

InChI Key

ONDPWWDPQDCQNJ-UHFFFAOYSA-N

Smiles

CC1(C)CNc2cc(NC(=O)c3cccnc3NCc3ccncc3)ccc21.O=P(O)(O)O.O=P(O)(O)O

InChI

InChI=1S/C22H23N5O.2H3O4P/c1-22(2)14-26-19-12-16(5-6-18(19)22)27-21(28)17-4-3-9-24-20(17)25-13-15-7-10-23-11-8-15;2*1-5(2,3)4/h3-12,26H,13-14H2,1-2H3,(H,24,25)(H,27,28);2*(H3,1,2,3,4)

Property Name	Value
Molecular Formula	C22H29N5O9P2
Molecular Weight	569.45
AlogP	4.04
Hydrogen Bond Acceptor	5.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	5.0
Polar Surface Area	78.94
Molecular species	NEUTRAL
Aromatic Rings	3.0
Heavy Atoms	28.0

Property Name

Value

Molecular Formula

C22H29N5O9P2

Molecular Weight

569.45

AlogP

4.04

Hydrogen Bond Acceptor

5.0

Hydrogen Bond Donor

3.0

Number of Rotational Bond

5.0

Polar Surface Area

78.94

Molecular species

NEUTRAL

Aromatic Rings

3.0

Heavy Atoms

28.0

Resources	Reference
ChEMBL	CHEMBL2107357
FDA SRS	T6Q3060U91
PubChem	16097729

Resources

Reference

ChEMBL

CHEMBL2107357

FDA SRS

T6Q3060U91

PubChem

16097729

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...

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Last update: Monday, 3 November 2025

MOTESANIB DIPHOSPHATE

Structure

Physicochemical Descriptors

Cross References