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Compound Detail

CHEMBL4598259

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CN(C)CCCN1C(=O)c2ccc3c4c(c(NCCCCNc5cc6c7c(ccc8c7c5C(=O)N(CCCN(C)C)C8=O)C(=O)N(CCCN(C)C)C6=O)cc(c24)C1=O)C(=O)N(CCCN(C)C)C3=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4598259
Phase Preclinical
Structure Type MOL
InChI Key FHIOAKSITZHTPZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

957.1
MW (Da)
4.49
ALogP
14
HBA
2
HBD
186.5
PSA (Ų)
0.08
QED
2
Ro5 Violations
23
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C52H64N10O8
MW 957.15
Aromatic Rings 4
Heavy Atoms 70
NP-Likeness -0.30

Data from ChEMBL 36 via Core Engine