MetaADEDB 2.0 @ LMMD
Aminopterin
(TVZGACDUOSZQKY-LBPRGKRZSA-N)
Structure
SMILES
OC(=O)CC[C@@H](C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(N)nc(n2)N
Type(s)
Investigational; Withdrawn
Molecular Formula:
C19H20N8O5
Molecular Weight:
440.413
Log P:
1.8704
Hydrogen Bond Acceptor:
13
Hydrogen Bond Donor:
6
TPSA:
219.33
CAS Number(s):
54-62-6
Synonym(s)
1.
Aminopterin
2.
Aminopterin Sodium
3.
Aminopterin, Disodium Salt
4.
Disodium Salt Aminopterin
5.
Sodium, Aminopterin
External Link(s)
MeSHD000630
PubChem Compound169371
BindingDB50367055
ChEBI22526
CHEMBLCHEMBL376180
DrugBankDB08878
DrugCentral21
KEGGdr:D02527
ZINC2036915
Adverse Drug Event(s)
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