MetaADEDB 2.0 @ LMMD
2-(3-mercaptopropyl)pentanedioic acid
(FNLNSQHJKVQCBP-UHFFFAOYSA-N)
Structure
SMILES
SCCCC(C(=O)O)CCC(=O)O
Molecular Formula:
C8H14O4S
Molecular Weight:
206.259
Log P:
1.2620
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
3
TPSA:
113.4
CAS Number(s):
254737-29-6
Synonym(s)
1.
2-(3-mercaptopropyl)pentanedioic acid
2.
2-MPPA cpd
3.
GPI 5693
External Link(s)
MeSHC474576
PubChem Compound10198171
BindingDB17755
CHEMBLCHEMBL303352
Therapeutic Target DatabaseD0Y7AN
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Cocaine-Related Disorders19887067CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120291

Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.