canSAR540100
FEATURES
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NAMES
    SMILES
    CS(=O)(=O)NC(=O)c1ccc(-c2ccc(CCNC[C@H](O)c3ccc(N)cc3)cc2)cc1OC1CCCCC1.Cl.Cl
    InChI
    InChI=1S/C30H37N3O5S.2ClH/c1-39(36,37)33-30(35)27-16-13-24(19-29(27)38-26-5-3-2-4-6-26)22-9-7-21(8-10-22)17-18-32-20-28(34)23-11-14-25(31)15-12-23;;/h7-16,19,26,28,32,34H,2-6,17-18,20,31H2,1H3,(H,33,35);2*1H/t28-;;/m0../s1
    MOLECULAR FORMULA
    C30H39Cl2N3O5S
    CROSS REFERENCES
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    canSAR540100
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight623.20
    AlogP5.05
    HBond donors5
    HBond acceptors8
    Atoms80
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR540100.