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Compound Detail

CHEMBL1183882

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C[N+]1(CCC(=O)Nc2ccc(NC(=O)CC[N+]3(C)CCCCC3CO)c3c2C(=O)c2ccccc2C3=O)CCCCC1CO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183882
Phase Preclinical
Structure Type MOL
InChI Key AIFJIBMJUVGPGF-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

606.8
MW (Da)
3.10
ALogP
6
HBA
4
HBD
132.8
PSA (Ų)
0.26
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H46N4O6+2
MW 606.76
Aromatic Rings 2
Heavy Atoms 44
NP-Likeness 0.08

Data from ChEMBL 36 via Core Engine