canSAR61357
FEATURES
Loading...
NAMES
    SMILES
    COc1cc2nc(N(C)CCCCCCN(C)C(=O)c3ccc(CN4CCSC4)cc3)nc(N)c2cc1OC
    InChI
    InChI=1S/C29H40N6O3S/c1-33(28(36)22-11-9-21(10-12-22)19-35-15-16-39-20-35)13-7-5-6-8-14-34(2)29-31-24-18-26(38-4)25(37-3)17-23(24)27(30)32-29/h9-12,17-18H,5-8,13-16,19-20H2,1-4H3,(H2,30,31,32)
    MOLECULAR FORMULA
    C29H40N6O3S
    CROSS REFERENCES
    Loading...
    canSAR61357
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight552.29
    AlogP4.50
    HBond donors2
    HBond acceptors9
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR61357.