BP-14979

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: XN7HA74WB0

Structure
InChI Key PLMAPPWZOQMTBI-XUTJKUGGSA-N
Smile COCCC(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(C#N)c3)CC2)CC1
InChI
InChI=1S/C23H34N4O2/c1-29-16-10-23(28)25-21-7-5-19(6-8-21)9-11-26-12-14-27(15-13-26)22-4-2-3-20(17-22)18-24/h2-4,17,19,21H,5-16H2,1H3,(H,25,28)/t19-,21-

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H34N4O2
Molecular Weight 398.55
AlogP 2.78
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 68.6
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 29.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Substance-Related Disorders 2 D019966 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4297484
DrugBank DB16302
FDA SRS XN7HA74WB0
SureChEMBL SCHEMBL13630506
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