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Compound Detail

CHEMBL1617632

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Nc1ccc2[nH]c(CCCO)nc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1617632
Phase Preclinical
Structure Type MOL
InChI Key BVNWGDZNXNWEIB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

191.2
MW (Da)
1.07
ALogP
3
HBA
3
HBD
74.9
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H13N3O
MW 191.23
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.98

Data from ChEMBL 36 via Core Engine