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Compound Detail

CHEMBL1189521

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CNC(=O)Oc1ccc2c(c1)[C@]1(C)CC[N@@+](C)([O-])[C@@H]1N2C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189521
Phase Preclinical
Structure Type MOL
InChI Key CWTQKLHIHKZUQO-DHSIGJKJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

291.4
MW (Da)
1.79
ALogP
4
HBA
1
HBD
64.6
PSA (Ų)
0.63
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H21N3O3
MW 291.35
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 0.86

Data from ChEMBL 36 via Core Engine