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canSAR1132343
FEATURES
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NAMES
    SMILES
    CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C)C(N)=O
    InChI
    InChI=1S/C56H73N9O11/c1-6-7-23-41(48(57)67)60-52(71)45-25-16-29-64(45)54(73)46-26-17-30-65(46)53(72)44(31-36-18-10-8-11-19-36)62-51(70)43(32-38-33-58-40-24-15-14-22-39(38)40)61-49(68)35(2)59-50(69)42(63-55(74)76-56(3,4)5)27-28-47(66)75-34-37-20-12-9-13-21-37/h8-15,18-22,24,33,35,41-46,58H,6-7,16-17,23,25-32,34H2,1-5H3,(H2,57,67)(H,59,69)(H,60,71)(H,61,68)(H,62,70)(H,63,74)/t35-,41-,42-,43+,44-,45-,46+/m0/s1
    MOLECULAR FORMULA
    C56H73N9O11
    CROSS REFERENCES
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    canSAR1132343

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1047.54
    AlogP 3.99
    HBond donors 8
    HBond acceptors 20
    Atoms 149
    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 canSAR1132343.