1087411 logo
canSAR1087411
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)C[C@@H](NC(=O)[C@H](O)[C@@H](S)C(=O)O)C(=O)NCCCCNC(=N)N
    InChI
    InChI=1S/C15H29N5O5S/c1-8(2)7-9(20-13(23)10(21)11(26)14(24)25)12(22)18-5-3-4-6-19-15(16)17/h8-11,21,26H,3-7H2,1-2H3,(H,18,22)(H,20,23)(H,24,25)(H4,16,17,19)/t9-,10-,11-/m1/s1
    MOLECULAR FORMULA
    C15H29N5O5S
    CROSS REFERENCES
    1087411 logo

    canSAR1087411

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.19
    AlogP -1.36
    HBond donors 8
    HBond acceptors 10
    Atoms 55
    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 canSAR1087411.