1143850 logo
canSAR1143850
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC[C@H](C)[C@H](NC[C@@H](N)CS)C(=O)N[C@H](C(=O)N[C@@H](CCO)C(=O)O)[C@@H](C)CC
    InChI
    InChI=1S/C19H38N4O5S/c1-5-11(3)15(21-9-13(20)10-29)17(25)23-16(12(4)6-2)18(26)22-14(7-8-24)19(27)28/h11-16,21,24,29H,5-10,20H2,1-4H3,(H,22,26)(H,23,25)(H,27,28)/t11-,12-,13+,14-,15-,16-/m0/s1
    MOLECULAR FORMULA
    C19H38N4O5S
    CROSS REFERENCES
    1143850 logo

    canSAR1143850

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 434.26
    AlogP -0.27
    HBond donors 7
    HBond acceptors 9
    Atoms 67
    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 canSAR1143850.