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Compound Detail

CHEMBL219456

HAMACANTHIN A
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O=C1N[C@@H](c2c[nH]c3cc(Br)ccc23)CN=C1c1c[nH]c2cc(Br)ccc12

Basic Information

ChEMBL ID CHEMBL219456
Name HAMACANTHIN A
Phase Preclinical
Structure Type MOL
InChI Key LJVUNJVGWMVCQH-GOSISDBHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
14
Publications
0
Known Names

Molecular Properties

486.2
MW (Da)
4.83
ALogP
2
HBA
3
HBD
73.0
PSA (Ų)
0.37
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C20H14Br2N4O
MW 486.17
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness 0.82

Literature References

Data from ChEMBL 36 via Core Engine