Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 2GWV496552

Structure

InChI Key SZFPYBIJACMNJV-UHFFFAOYSA-N
Smile CCCCCCCCCCCCCCCCCCOP(=O)([O-])OC1CC[N+](C)(C)CC1
InChI
InChI=1S/C25H52NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-29-31(27,28)30-25-20-22-26(2,3)23-21-25/h25H,4-24H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H52NO4P
Molecular Weight 461.67
AlogP 6.99
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 20.0
Polar Surface Area 58.59
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 31.0

Pharmacology

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Colorectal Neoplasms 3 D015179 ClinicalTrials
Multiple Myeloma 3 D009101 ClinicalTrials
Leukemia 2 D007938 ClinicalTrials
Prostatic Neoplasms 2 D011471 ClinicalTrials
Carcinoma, Renal Cell 2 D002292 ClinicalTrials
Leukemia, Lymphocytic, Chronic, B-Cell 2 D015451 ClinicalTrials
Lymphoma 2 D008223 ClinicalTrials
Melanoma 2 D008545 ClinicalTrials
Pancreatic Neoplasms 2 D010190 ClinicalTrials
Head and Neck Neoplasms 2 D006258 ClinicalTrials
Gastrointestinal Stromal Tumors 2 D046152 ClinicalTrials
Waldenstrom Macroglobulinemia 2 D008258 ClinicalTrials
Sarcoma 2 D012509 ClinicalTrials
Kidney Neoplasms 2 D007680 ClinicalTrials
Breast Neoplasms 2 D001943 ClinicalTrials
Prostatic Neoplasms, Castration-Resistant 2 D064129 ClinicalTrials
Colonic Neoplasms 2 D003110 ClinicalTrials
Astrocytoma 1 D001254 ClinicalTrials
Oligodendroglioma 1 D009837 ClinicalTrials
Ovarian Neoplasms 1 D010051 ClinicalTrials
Leukemia, Megakaryoblastic, Acute 1 D007947 ClinicalTrials
Leukemia, Myeloid, Acute 1 D015470 ClinicalTrials
Leukemia, Myeloid, Acute 1 D015470 ClinicalTrials
Oligodendroglioma 1 D009837 ClinicalTrials
Gliosarcoma 1 D018316 ClinicalTrials
Neoplasms 1 D009369 ClinicalTrials
Glioma 1 D005910 ClinicalTrials
Brain Neoplasms 1 D001932 ClinicalTrials
Carcinoma, Non-Small-Cell Lung 1 D002289 ClinicalTrials
Myelodysplastic Syndromes 1 D009190 ClinicalTrials
Leukemia, Biphenotypic, Acute 1 D015456 ClinicalTrials
Leukemia, Monocytic, Acute 1 D007948 ClinicalTrials
Leukemia, Myelomonocytic, Acute 1 D015479 ClinicalTrials
Leukemia, Promyelocytic, Acute 1 D015473 ClinicalTrials
Leukemia, Myelogenous, Chronic, BCR-ABL Positive 1 D015464 ClinicalTrials
Leukemia, Erythroblastic, Acute 1 D004915 ClinicalTrials
Glioblastoma 1 D005909 ClinicalTrials
Neoplasms 1 D009369 ClinicalTrials

Related Entries

MCS

Cross References

Resources Reference
CAS NUMBER 157716-52-4
ChEBI 67272
ChEMBL CHEMBL372764
DrugBank DB06641
EPA CompTox DTXSID3048946
FDA SRS 2GWV496552
Guide to Pharmacology 7424
PubChem 148177
SureChEMBL SCHEMBL93872