Synonyms:
Status: Phase 3
Entry Type: Protein
Molecule Category: UNKNOWN
UNII: NMG938VJ6T

Structure

InChI Key DVJXNXPFYJIACK-ULQDDVLXSA-N
Smile NCCCC[C@@H]1NC(=O)[C@H](CCC(=O)O)NC(=O)c2cc([N+](=O)[O-])ccc2OCC[C@@H](C(=O)NCC(=O)O)NC1=O
InChI
InChI=1S/C24H32N6O11/c25-9-2-1-3-15-23(37)29-17(22(36)26-12-20(33)34)8-10-41-18-6-4-13(30(39)40)11-14(18)21(35)27-16(24(38)28-15)5-7-19(31)32/h4,6,11,15-17H,1-3,5,7-10,12,25H2,(H,26,36)(H,27,35)(H,28,38)(H,29,37)(H,31,32)(H,33,34)/t15-,16-,17-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H32N6O11
Molecular Weight 580.55
AlogP -1.36
Hydrogen Bond Acceptor 10.0
Hydrogen Bond Donor 7.0
Number of Rotational Bond 11.0
Polar Surface Area 269.39
Molecular species ZWITTERION
Aromatic Rings 1.0
Heavy Atoms 41.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Dry Eye Syndromes 3 D015352 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL3544981
DrugBank DB12441
EPA CompTox DTXSID00180937
FDA SRS NMG938VJ6T
PubChem 9808372
SureChEMBL SCHEMBL15468298
ZINC ZINC000136639443