For research use only. Not for therapeutic Use.
ZINC08792355(Cat No.:I038712)is a compound available in the ZINC database, which is a collection of commercially available compounds for drug discovery. It is a small molecule that has been investigated for its potential therapeutic properties in various biological systems. The compound’s exact mechanism of action, biological targets, and therapeutic applications are typically explored through screening studies to identify its effectiveness in treating diseases, including cancer, infectious diseases, or neurodegenerative disorders. Researchers may use ZINC08792355 for further drug development and optimization, exploring its binding affinity and pharmacokinetics to determine its potential as a drug candidate.
Catalog Number | I038712 |
CAS Number | 904513-52-6 |
Synonyms | ZINC08792355 |
Molecular Formula | C31H24N4O3 |
Purity | 98% |
Solubility | Soluble in DMSO |
Appearance | Solid powder |
Storage | Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years). |
IUPAC Name | N-[2-(1H-indol-3-yl)ethyl]-2-[(19-oxo-1,11-diazapentacyclo[10.7.1.02,7.08,20.013,18]icosa-2(7),3,5,8(20),9,11,13,15,17-nonaen-5-yl)oxy]propanamide |
InChI | InChI=1S/C31H24N4O3/c1-18(30(36)33-14-12-19-17-34-26-9-5-4-6-21(19)26)38-20-10-11-27-25(16-20)23-13-15-32-28-22-7-2-3-8-24(22)31(37)35(27)29(23)28/h2-11,13,15-18,34H,12,14H2,1H3,(H,33,36) |
InChIKey | YNALEBZPGHPNGU-UHFFFAOYSA-N |
SMILES | CC(C(=O)NCCC1=CNC2=CC=CC=C21)OC3=CC4=C(C=C3)N5C6=C4C=CN=C6C7=CC=CC=C7C5=O |
Reference | 1: Sun Y, Zhou H, Zhu H, Leung SW. Ligand-based virtual screening and inductive learning for identification of SIRT1 inhibitors in natural products. Sci Rep. 2016 Jan 25;6:19312. doi: 10.1038/srep19312. PubMed PMID: 26805727; PubMed Central PMCID: PMC4726279. |