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Compound Detail

CHEMBL1184768

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Cc1nc(O)c2cc(CN(C)c3ccc(C(=O)N[C@@H](CCC(=O)N[C@H](CCC(=O)O)C(=O)O)C(=O)O)cc3)c(C)cc2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184768
Phase Preclinical
Structure Type MOL
InChI Key MPYXWMLJPLQQLA-YADHBBJMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

595.6
MW (Da)
1.99
ALogP
9
HBA
6
HBD
219.3
PSA (Ų)
0.16
QED
2
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H33N5O9
MW 595.61
Aromatic Rings 3
Heavy Atoms 43
NP-Likeness -0.70

Data from ChEMBL 36 via Core Engine