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Compound Detail

CHEMBL1194469

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Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4nc5cc(NC(=O)c6ccc(N(CCCl)CCCl)cc6)ccc5[nH]4)cn3C)cn2C)cc1C(=O)NCCC(=N)N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194469
Phase Preclinical
Structure Type MOL
InChI Key VTUJRELIRZNVDP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

856.8
MW (Da)
4.93
ALogP
11
HBA
8
HBD
242.1
PSA (Ų)
0.04
QED
3
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C40H43Cl2N13O5
MW 856.78
Aromatic Rings 6
Heavy Atoms 60
NP-Likeness -0.81

Data from ChEMBL 36 via Core Engine