MetaADEDB 2.0 @ LMMD
batimastat
(XFILPEOLDIKJHX-QYZOEREBSA-N)
Structure
SMILES
CNC(=O)[C@@H](NC(=O)[C@@H]([C@@H](C(=O)NO)CSc1cccs1)CC(C)C)Cc1ccccc1
Type(s)
Experimental
Molecular Formula:
C23H31N3O4S2
Molecular Weight:
477.640
Log P:
4.2703
Hydrogen Bond Acceptor:
9
Hydrogen Bond Donor:
4
TPSA:
161.07
CAS Number(s):
130370-60-4
Synonym(s)
1.
batimastat
2.
(4-(N-hydroxyamino)-2-isobutyl-3-(thiophen-2-ylthiomethyl)succinyl)phenylalanine-N-methylamide
3.
BB 94
4.
BB-94
5.
BB94 cpd
External Link(s)
MeSHC080985
PubChem Compound5362422
BindingDB50063918
CHEMBLCHEMBL279786
DrugBankDB03880
IUPHAR/BPS Guide to PHARMACOLOGY5145
KEGGdr:D03061
Therapeutic Target DatabaseD0P8YC
ZINC3789788
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Cerebral Hemorrhage17971790CTD
2Pituitary Neoplasms17235567CTD
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