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canSAR835261
FEATURES
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NAMES
    SMILES
    CC(C)C[C@@H]1NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc(NC(=O)C(C)C)cc2)NC1=O
    InChI
    InChI=1S/C64H99N13O11/c1-36(2)32-46-57(81)72-48(34-41-18-12-11-13-19-41)63(87)76-30-16-22-50(76)59(83)74-52(38(5)6)61(85)69-45(21-15-29-66)56(80)71-47(33-37(3)4)58(82)73-49(35-42-24-26-43(27-25-42)67-54(78)40(9)10)64(88)77-31-17-23-51(77)60(84)75-53(39(7)8)62(86)68-44(20-14-28-65)55(79)70-46/h11-13,18-19,24-27,36-40,44-53H,14-17,20-23,28-35,65-66H2,1-10H3,(H,67,78)(H,68,86)(H,69,85)(H,70,79)(H,71,80)(H,72,81)(H,73,82)(H,74,83)(H,75,84)/t44-,45-,46-,47-,48-,49-,50-,51-,52-,53-/m0/s1
    MOLECULAR FORMULA
    C64H99N13O11
    CROSS REFERENCES
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    canSAR835261

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1225.76
    AlogP 1.82
    HBond donors 13
    HBond acceptors 24
    Atoms 187
    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 canSAR835261.