2086466 logo
canSAR2086466
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@]12CC[C@H]3[C@@H](CC=C4C=C(c5nnn[nH]5)CC[C@@]43C)[C@@H]1CCC(=O)N2
    InChI
    InChI=1S/C20H27N5O/c1-19-9-7-12(18-22-24-25-23-18)11-13(19)3-4-14-15(19)8-10-20(2)16(14)5-6-17(26)21-20/h3,11,14-16H,4-10H2,1-2H3,(H,21,26)(H,22,23,24,25)/t14-,15+,16+,19+,20+/m1/s1
    MOLECULAR FORMULA
    C20H27N5O
    CROSS REFERENCES
    2086466 logo

    canSAR2086466

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.22
    AlogP 3.02
    HBond donors 2
    HBond acceptors 6
    Atoms 53
    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 canSAR2086466.