1021690 logo
canSAR1021690
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCNC(=O)N[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1
    InChI
    InChI=1S/C22H36N2O2/c1-4-23-20(26)24-15-9-11-21(2)14(13-15)5-6-16-17-7-8-19(25)22(17,3)12-10-18(16)21/h14-18H,4-13H2,1-3H3,(H2,23,24,26)/t14-,15-,16-,17-,18-,21-,22-/m0/s1
    MOLECULAR FORMULA
    C22H36N2O2
    CROSS REFERENCES
    1021690 logo

    canSAR1021690

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.28
    AlogP 4.29
    HBond donors 2
    HBond acceptors 4
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1021690.