canSAR289754
FEATURES
Loading...
NAMES
    SMILES
    COc1cc(NC(C)CCCN2C(=O)CN(C(=O)[C@H](N)CCSC)C2(C)C)c2ncccc2c1
    InChI
    InChI=1S/C25H37N5O3S/c1-17(28-21-15-19(33-4)14-18-9-6-11-27-23(18)21)8-7-12-29-22(31)16-30(25(29,2)3)24(32)20(26)10-13-34-5/h6,9,11,14-15,17,20,28H,7-8,10,12-13,16,26H2,1-5H3/t17?,20-/m1/s1
    MOLECULAR FORMULA
    C25H37N5O3S
    CROSS REFERENCES
    Loading...
    canSAR289754
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight487.26
    AlogP3.31
    HBond donors3
    HBond acceptors8
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR289754.