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CER-0262939
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NAMES
  • CER-0262939
SMILES
Nc1nc(Nc2ccc3ncsc3c2)cc(N2CCC[C@H]2C(=O)NCCc2cccc(I)c2)n1
InChI
InChI=1S/C24H24IN7OS/c25-16-4-1-3-15(11-16)8-9-27-23(33)19-5-2-10-32(19)22-13-21(30-24(26)31-22)29-17-6-7-18-20(12-17)34-14-28-18/h1,3-4,6-7,11-14,19H,2,5,8-10H2,(H,27,33)(H3,26,29,30,31)/t19-/m0/s1
MOLECULAR FORMULA
C24H24IN7OS
CROSS REFERENCES
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CER-0262939

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 585.08
AlogP 4.34
HBond donors 4
HBond acceptors 8
Atoms 58
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 CER-0262939.