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Compound Detail

CHEMBL4597154

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CN(C)CCN1C(=O)c2ccc3c4c(c(C#Cc5ccc(CN(C)C)c(O)c5)cc(c24)C1=O)C(=O)N(CCN(C)C)C3=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597154
Phase Preclinical
Structure Type MOL
InChI Key VXTVWBPVHJFHRM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

581.7
MW (Da)
2.32
ALogP
8
HBA
1
HBD
104.7
PSA (Ų)
0.32
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H35N5O5
MW 581.67
Aromatic Rings 3
Heavy Atoms 43
NP-Likeness -0.37

Data from ChEMBL 36 via Core Engine