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Chemical structure of NV03

GC64772

NV03

Also known as N-[3-(diethylamino)propyl]-2-(7,12-dimethyl-9-oxo-5-thia-1,10,11-triazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,11-tetraen-10-yl)acetamide

NV03 is a potent and selective antagonist of UHRF1 (Ubiquitin-like with PHD and RING finger domains 1)- H3K9me3 interaction by binding to UHRF1 tandem tudor domain, with a Kd of 2·4 μM· NV03 has anticancer activity

ChemicalCAS2448341-58-8MW389.51FormulaC19H27N5O2S
CAS number
2448341-58-8
Molecular weight
389.51
Formula
C19H27N5O2S
InChIKey
KNZQAVKYBBYDKV-UHFFFAOYSA-N
Catalogue number
GC64772
Brand
GLPBIO
Computed properties PubChem CID 139291004 · XLogP 2.3 · TPSA 98.2 Ų · H-bond donors 1
XLogP
2.3
TPSA
98.2 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
27

SMILES CCN(CC)CCCNC(=O)CN1C(=O)C2=C(C3=C(N2C(=N1)C)C=CS3)C

Computed descriptors from PubChem (CID 139291004), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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