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Compound Detail

CHEMBL1186334

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CN(C)c1ccc(-c2cc3c4c(c2)-c2c(ccc(O)c2O)C[C@H]4N(C)CC3)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186334
Phase Preclinical
Structure Type MOL
InChI Key BSBMMXOBOAVGQD-OAQYLSRUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.5
MW (Da)
4.58
ALogP
4
HBA
2
HBD
46.9
PSA (Ų)
0.63
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H26N2O2
MW 386.50
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness 0.72

Data from ChEMBL 36 via Core Engine