MetaADEDB 2.0 @ LMMD
3,9-bis((ethylthio)methyl)-K-252a
(SCMLRESZJCKCTC-KMYQRJGFSA-N)
Structure
SMILES
CCSCc1ccc2c(c1)c1c3C(=O)NCc3c3c4c1n2[C@H]1C[C@]([C@](O1)(n4c1c3cc(cc1)CSCC)C)(O)C(=O)OC
Molecular Formula:
C33H33N3O5S2
Molecular Weight:
615.762
Log P:
6.4901
Hydrogen Bond Acceptor:
10
Hydrogen Bond Donor:
2
TPSA:
145.32
CAS Number(s):
N/A
Synonym(s)
1.
3,9-bis((ethylthio)methyl)-K-252a
2.
3,9-bis(EtSM)-K-252a
3.
CEP 1347
4.
CEP-1347
5.
CEP1347
6.
KT 7515
7.
KT-7515
8.
KT7515
External Link(s)
MeSHC106592
PubChem Compound9917013
BindingDB24942
CHEMBLCHEMBL290352
IUPHAR/BPS Guide to PHARMACOLOGY8173
Therapeutic Target DatabaseD0U7UY
ZINC3928304
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Mercury Poisoning, Nervous System21385734CTD
2Nerve Degeneration10627579CTD
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