830753 logo
canSAR830753
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C=CCNC(=O)C(=O)[C@@H]1CCCCCCCCC[C@H](NC(=O)N[C@H](C(=O)C2CC2)C(C)C)C(=O)N2C[C@@H]3[C@H]([C@H]2C(=O)N1)C3(C)C
    InChI
    InChI=1S/C34H53N5O6/c1-6-18-35-31(43)29(41)23-14-12-10-8-7-9-11-13-15-24(37-33(45)38-26(20(2)3)28(40)21-16-17-21)32(44)39-19-22-25(34(22,4)5)27(39)30(42)36-23/h6,20-27H,1,7-19H2,2-5H3,(H,35,43)(H,36,42)(H2,37,38,45)/t22-,23+,24+,25-,26+,27+/m1/s1
    MOLECULAR FORMULA
    C34H53N5O6
    CROSS REFERENCES
    830753 logo

    canSAR830753

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 627.40
    AlogP 3.02
    HBond donors 4
    HBond acceptors 11
    Atoms 98
    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 canSAR830753.