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Agelanesin A
FEATURES
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NAMES
  • AGELANESIN A
SMILES
CN(C)CCc1ccc(OCCCNC(=O)c2cc(Br)c[nH]2)c(Br)c1
InChI
InChI=1S/C18H23Br2N3O2/c1-23(2)8-6-13-4-5-17(15(20)10-13)25-9-3-7-21-18(24)16-11-14(19)12-22-16/h4-5,10-12,22H,3,6-9H2,1-2H3,(H,21,24)
MOLECULAR FORMULA
C18H23Br2N3O2
CROSS REFERENCES
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Agelanesin A

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 471.02
AlogP 3.84
HBond donors 2
HBond acceptors 5
Atoms 48
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Agelanesin A.