Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 94H892992X

Structure

InChI Key SGDBTWWWUNNDEQ-GFCCVEGCSA-N
Smile N[C@H](Cc1ccc(N(CCCl)CCCl)cc1)C(=O)O
InChI
InChI=1S/C13H18Cl2N2O2/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H18Cl2N2O2
Molecular Weight 305.21
AlogP 1.93
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 66.56
Molecular species ZWITTERION
Aromatic Rings 1.0
Heavy Atoms 19.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Sarcoma, Ewing 3 D012512 ClinicalTrials
Multiple Myeloma 3 D009101 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL250892
EPA CompTox DTXSID00893737
FDA SRS 94H892992X
KEGG C19442
SureChEMBL SCHEMBL5873
ZINC ZINC000000001661