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Compound Detail

CHEMBL1193249

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Cc1ccc2cccc(OCc3c(C(=O)N(C)C)ccc(N(C)C(=O)CNC(=O)/C=C/c4ccc(C(=O)N(C)C)cc4)c3C(=O)N(C)C)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1193249
Phase Preclinical
Structure Type MOL
InChI Key HQDLMDUXNLTVKH-RCCKNPSSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

678.8
MW (Da)
4.02
ALogP
7
HBA
1
HBD
132.5
PSA (Ų)
0.24
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H42N6O6
MW 678.79
Aromatic Rings 4
Heavy Atoms 50
NP-Likeness -1.02

Data from ChEMBL 36 via Core Engine