canSAR2060285
FEATURES
Loading...
NAMES
    SMILES
    CN1c2ccccc2C2(C)CCN(C(=O)Cn3c[n+](CC(=O)c4ccc5ccccc5c4)c4ccccc43)C12.[Br-]
    InChI
    InChI=1S/C33H31N4O2.BrH/c1-33-17-18-37(32(33)34(2)27-12-6-5-11-26(27)33)31(39)21-36-22-35(28-13-7-8-14-29(28)36)20-30(38)25-16-15-23-9-3-4-10-24(23)19-25;/h3-16,19,22,32H,17-18,20-21H2,1-2H3;1H/q+1;/p-1
    MOLECULAR FORMULA
    C33H31BrN4O2
    CROSS REFERENCES
    Loading...
    canSAR2060285
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight594.16
    AlogP1.94
    HBond donors0
    HBond acceptors6
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2060285.