1515386 logo
canSAR1515386
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CN1CCN(c2cc(C(=O)NCCN(CCC(=O)NCCOCCOCCNC(=O)COc3ccc4ccccc4c3)CCC(=O)NCCOCCOCCNC(=O)COc3ccc4ccccc4c3)c3nc(-c4ccc5nc(-c6ccc(O)cc6)[nH]c5c4)[nH]c3c2)CC1
    InChI
    InChI=1S/C70H82N12O12/c1-80-30-32-82(33-31-80)55-45-59(67-62(46-55)78-69(79-67)54-14-19-60-61(44-54)77-68(76-60)51-10-15-56(83)16-11-51)70(88)75-22-29-81(27-20-63(84)71-23-34-89-38-40-91-36-25-73-65(86)47-93-57-17-12-49-6-2-4-8-52(49)42-57)28-21-64(85)72-24-35-90-39-41-92-37-26-74-66(87)48-94-58-18-13-50-7-3-5-9-53(50)43-58/h2-19,42-46,83H,20-41,47-48H2,1H3,(H,71,84)(H,72,85)(H,73,86)(H,74,87)(H,75,88)(H,76,77)(H,78,79)
    MOLECULAR FORMULA
    C70H82N12O12
    CROSS REFERENCES
    1515386 logo

    canSAR1515386

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1282.62
    AlogP 6.04
    HBond donors 8
    HBond acceptors 24
    Atoms 176
    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 canSAR1515386.