NF770

Ligand id: 9545

Name: NF770

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 23
Hydrogen bond donors 10
Rotatable bonds 22
Topological polar surface area 426.99
Molecular weight 1196.15
XLogP 6.3
No. Lipinski's rules broken 4

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-methoxy-3-[[3-[[3-[[3-[[5-[(8-methoxy-3,6-disulfonaphthalen-2-yl)carbamoyl]-2-methylphenyl]carbamoyl]phenyl]carbamoylamino]benzoyl]amino]-4-methylbenzoyl]amino]naphthalene-2,7-disulfonic acid
Database Links
PubChem CID 53310474
Search Google for chemical match using the InChIKey OVDXRPYTXUZANY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone OVDXRPYTXUZANY
Search UniChem for chemical match using the InChIKey OVDXRPYTXUZANY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone OVDXRPYTXUZANY
Comments
NF770 is a P2X2 receptor antagonist [1]. Note that we show the salt (Na) stripped structure, but strictly NF770 is the tetra sodium salt shown in PubChem CID 53310473. This structure matches example 8b in patent US20130338178 [3] claiming suramin derivatives as sirtuin modulators.