1123787 logo
canSAR1123787
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=O)NCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O
    InChI
    InChI=1S/C32H53N9O6/c1-19(2)16-24(29(45)39-23(28(33)44)12-9-14-37-32(34)35)40-30(46)25(17-20(3)4)41-31(47)26(18-22-10-7-6-8-11-22)38-27(43)13-15-36-21(5)42/h6-8,10-11,19-20,23-26H,9,12-18H2,1-5H3,(H2,33,44)(H,36,42)(H,38,43)(H,39,45)(H,40,46)(H,41,47)(H4,34,35,37)/t23-,24-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C32H53N9O6
    CROSS REFERENCES
    1123787 logo

    canSAR1123787

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 659.41
    AlogP -0.67
    HBond donors 11
    HBond acceptors 15
    Atoms 100
    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 canSAR1123787.