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Compound Detail

CHEMBL1192558

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N[C@]1(C(=O)O)C[C@H](C(=O)O)N(Cc2ccccn2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1192558
Phase Preclinical
Structure Type MOL
InChI Key DBFCNSLCXUQJOU-BXKDBHETSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

265.3
MW (Da)
-0.48
ALogP
5
HBA
3
HBD
116.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H15N3O4
MW 265.27
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.60

Data from ChEMBL 36 via Core Engine