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Compound Detail

CHEMBL1181133

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NCCCCNC(=O)NCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1181133
Phase Preclinical
Structure Type MOL
InChI Key YDDNAFVVICELLO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

221.3
MW (Da)
1.22
ALogP
2
HBA
3
HBD
67.2
PSA (Ų)
0.63
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H19N3O
MW 221.30
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -1.01

Data from ChEMBL 36 via Core Engine