Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 75QG9WGN4U

Structure

InChI Key AHNIKTNNZJNCFN-CNEPGKQSSA-N
Smile CCc1c(CC)c2cc3nc(cnc4cc(OCCOCCOCCOC)c(OCCOCCOCCOC)cc4ncc4nc(cc1[nH]2)C(CCCO)=C4C)C(C)=C3CCCO
InChI
InChI=1S/C48H67N5O10/c1-7-35-36(8-2)40-28-42-38(12-10-14-55)34(4)46(53-42)32-50-44-30-48(63-26-24-61-22-20-59-18-16-57-6)47(62-25-23-60-21-19-58-17-15-56-5)29-43(44)49-31-45-33(3)37(11-9-13-54)41(52-45)27-39(35)51-40/h27-32,51,54-55H,7-26H2,1-6H3/b39-27-,40-28-,41-27-,42-28-,45-31-,46-32-,49-31+,49-43+,50-32+,50-44+

Physicochemical Descriptors

Property Name Value
Molecular Formula C48H67N5O10
Molecular Weight 874.09
AlogP 6.99
Hydrogen Bond Acceptor 14.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 28.0
Polar Surface Area 181.65
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 63.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Prostatic Neoplasms 1 D011471 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL2104414
FDA SRS 75QG9WGN4U
PubChem 151071