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Compound Detail

CHEMBL5499703

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Cc1cc2[nH]ncc2c(-c2ncc3c(N4C[C@H]5CC[C@@H](C4)N5)nc(OCC45CCCN4CC(=C(F)F)C5)nc3c2F)c1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499703
Phase Preclinical
Structure Type MOL
InChI Key ZFOFRNGUMIFHIU-YWFGESALSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

611.1
MW (Da)
5.38
ALogP
8
HBA
2
HBD
95.1
PSA (Ų)
0.31
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H30ClF3N8O
MW 611.07
Aromatic Rings 4
Heavy Atoms 43
NP-Likeness -0.58

Data from ChEMBL 36 via Core Engine