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Compound Detail

CHEMBL2078735

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COCCCOc1ccccc1N1CCN(CC(N)C(O)CC(C(=O)NCC(C)(C)C(N)=O)C(C)C)C(C)(C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2078735
Phase Preclinical
Structure Type MOL
InChI Key VQDNVZMEUJZUNX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

577.8
MW (Da)
1.51
ALogP
8
HBA
4
HBD
160.4
PSA (Ų)
0.22
QED
1
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H51N5O6
MW 577.77
Aromatic Rings 1
Heavy Atoms 41
NP-Likeness -0.26

Data from ChEMBL 36 via Core Engine