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Compound Detail

CHEMBL1789432

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COCCOCCOCCOc1cc2c(cc1OC)CCN(CCc1ccc(NC(=O)c3ccc(C(=O)O)c(NC(=O)c4ccc5ncccc5c4)c3)cc1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1789432
Phase Preclinical
Structure Type MOL
InChI Key VLEZERHTRVZAQV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

762.9
MW (Da)
6.11
ALogP
10
HBA
3
HBD
157.8
PSA (Ų)
0.08
QED
2
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C43H46N4O9
MW 762.86
Aromatic Rings 5
Heavy Atoms 56
NP-Likeness -1.01

Data from ChEMBL 36 via Core Engine