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Compound Detail

CHEMBL1186689

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CCCN1CCN(c2ncc(CCNC)s2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186689
Phase Preclinical
Structure Type MOL
InChI Key OJBJXDJYGJTNEH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

268.4
MW (Da)
1.44
ALogP
5
HBA
1
HBD
31.4
PSA (Ų)
0.85
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 C13H24N4S
MW 268.43
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -1.70

Data from ChEMBL 36 via Core Engine