MetaADEDB 2.0 @ LMMD
EC145
(KUZYSQSABONDME-QRLOMCMNSA-N)
Structure
SMILES
COc1cc2N(C)[C@@H]3[C@@]4(c2cc1[C@]1(C[C@H]2CN(CCc5c1[nH]c1c5cccc1)C[C@](C2)(O)CC)C(=O)OC)CCN1[C@H]4[C@@]([C@H]([C@]3(O)C(=O)NNC(=O)OCCSSC[C@@H](C(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@@H](C(=O)O)NC(=O)c2ccc(cc2)NCc2cnc3c(n2)c(=O)nc([nH]3)N)CC(=O)O)CCCNC(=N)N)CC(=O)O)CC(=O)O)O)(CC)C=CC1
Type(s)
Investigational
ATC code(s)
L01CA06
Molecular Formula:
C86H109N21O26S2
Molecular Weight:
1917.040
Log P:
3.3792
Hydrogen Bond Acceptor:
47
Hydrogen Bond Donor:
23
TPSA:
772.34
CAS Number(s):
742092-03-1
Synonym(s)
1.
EC145
2.
vintafolide
External Link(s)
MeSHC520389
PubChem Compound25014653
102359952
122173811
71301286
ChEBI134736
CHEMBLCHEMBL3039521
DrugBankDB05168
DrugCentral4831
Therapeutic Target DatabaseD09JGH
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Constipation19837906CTD
2Neoplasms17483358CTD
3Peripheral Nervous System Diseases19837906CTD
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