canSAR824471
FEATURES
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NAMES
    SMILES
    CCN(CC)CCN(CCCN)CCCNC(=O)[C@H]1NC(=O)[C@H]2NC(=O)[C@H](NC(=O)[C@@H]3NC(=O)[C@H]4NC(=O)[C@@H](Cc5ccc(c(Cl)c5)Oc5cc3cc(c5O)Oc3ccc(cc3Cl)[C@H]2O)NC(=O)[C@H](N)c2ccc(O)c(c2)Oc2cc(O)cc4c2)c2ccc(O)c(c2)-c2c(O)cc(O)cc21
    InChI
    InChI=1S/C70H73Cl2N11O17/c1-3-82(4-2)19-20-83(17-5-15-73)18-6-16-75-66(93)60-43-31-40(85)32-49(88)55(43)42-25-35(9-11-47(42)86)57-67(94)81-61(70(97)80-60)62(89)36-10-14-51(45(72)26-36)100-54-29-38-28-53(63(54)90)99-50-13-7-33(21-44(50)71)22-46-64(91)77-58(68(95)79-59(38)69(96)78-57)37-23-39(84)30-41(24-37)98-52-27-34(8-12-48(52)87)56(74)65(92)76-46/h7-14,21,23-32,46,56-62,84-90H,3-6,15-20,22,73-74H2,1-2H3,(H,75,93)(H,76,92)(H,77,91)(H,78,96)(H,79,95)(H,80,97)(H,81,94)/t46-,56-,57-,58+,59-,60-,61+,62-/m1/s1
    MOLECULAR FORMULA
    C70H73Cl2N11O17
    CROSS REFERENCES
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    canSAR824471
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1409.46
    AlogP5.40
    HBond donors18
    HBond acceptors28
    Atoms173
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824471.