1618019 logo
canSAR1618019
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)[C@]12CCCCC=C1N(Cc1ccc(Cl)cc1Cl)C(=O)[C@H](CC(=O)NCC1CCCCC1)C2
    InChI
    InChI=1S/C28H36Cl2N2O4/c1-36-27(35)28-13-7-3-6-10-24(28)32(18-20-11-12-22(29)15-23(20)30)26(34)21(16-28)14-25(33)31-17-19-8-4-2-5-9-19/h10-12,15,19,21H,2-9,13-14,16-18H2,1H3,(H,31,33)/t21-,28+/m1/s1
    MOLECULAR FORMULA
    C28H36Cl2N2O4
    CROSS REFERENCES
    1618019 logo

    canSAR1618019

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 534.21
    AlogP 6.05
    HBond donors 1
    HBond acceptors 6
    Atoms 72
    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 canSAR1618019.