1633516 logo
canSAR1633516
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CN(C(=O)[C@H](Cc1ccc(CC[NH3+])cc1)NS(=O)(=O)c1ccc2ccccc2c1)C1CCCC1
    InChI
    InChI=1S/C27H33N3O3S/c1-30(24-8-4-5-9-24)27(31)26(18-21-12-10-20(11-13-21)16-17-28)29-34(32,33)25-15-14-22-6-2-3-7-23(22)19-25/h2-3,6-7,10-15,19,24,26,29H,4-5,8-9,16-18,28H2,1H3/p+1/t26-/m0/s1
    MOLECULAR FORMULA
    C27H34N3O3S+
    CROSS REFERENCES
    1633516 logo

    canSAR1633516

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.23
    AlogP 2.91
    HBond donors 4
    HBond acceptors 6
    Atoms 68
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1633516.