MASOPROCOL

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Trade Names:
Synonyms:
Status: Approved (1992)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: L01XX10
UNII: 7BO8G1BYQU

Structure
InChI Key HCZKYJDFEPMADG-TXEJJXNPSA-N
Smile C[C@@H](Cc1ccc(O)c(O)c1)[C@H](C)Cc1ccc(O)c(O)c1
InChI
InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3/t11-,12+

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H22O4
Molecular Weight 302.37
AlogP 3.57
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 5.0
Polar Surface Area 80.92
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 22.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Prostatic Neoplasms, Castration-Resistant 2 D064129 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 27686-84-6
ChEBI 73468
ChEMBL CHEMBL313972
DrugBank DB00179
DrugCentral 1637
EPA CompTox DTXSID5045178
FDA SRS 7BO8G1BYQU
Human Metabolome Database HMDB0014325
KEGG C10719
PharmGKB PA164746493
PubChem 71398
SureChEMBL SCHEMBL3818
ZINC ZINC000000012342
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