MetaADEDB 2.0 @ LMMD
VX680
(GCIKSSRWRFVXBI-UHFFFAOYSA-N)
Structure
SMILES
CN1CCN(CC1)c1nc(Sc2ccc(cc2)NC(=O)C2CC2)nc(c1)Nc1n[nH]c(c1)C
Molecular Formula:
C23H28N8OS
Molecular Weight:
464.586
Log P:
3.6521
Hydrogen Bond Acceptor:
8
Hydrogen Bond Donor:
3
TPSA:
127.37
CAS Number(s):
639089-54-6; 936915-58-1
Synonym(s)
1.
VX680
2.
MK-0457
3.
Tozasertib
4.
VE 465
5.
VE-465
6.
VX-680
7.
cyclopropane carboxylic acid(4-(4-(4-methylpiperazin-1-yl)-6-(5-methyl-2H-pyrazol-3-ylamino)pyrimidin-2-ylsulfanyl)phenyl)amide
External Link(s)
MeSHC484810
PubChem Compound5494449
BindingDB13534
50004205
ChEBI91336
CHEMBLCHEMBL572878
IUPHAR/BPS Guide to PHARMACOLOGY5718
KEGGdr:D08279
Therapeutic Target DatabaseD02XNW
ZINC3820040
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Neoplasms18765535CTD
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