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Compound Detail

CHEMBL4115977

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CCC(=O)NC1CN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4115977
Phase Preclinical
Structure Type MOL
InChI Key ICZVKTVMHVHOQI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

950.2
MW (Da)
8.12
ALogP
9
HBA
3
HBD
140.9
PSA (Ų)
0.10
QED
2
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C56H71N9O5
MW 950.24
Aromatic Rings 4
Heavy Atoms 70
NP-Likeness -0.49

Data from ChEMBL 36 via Core Engine