canSAR821176
FEATURES
Loading...
NAMES
    SMILES
    CCCC[C@H](NC(C)=O)C(=O)NC1CC(=O)NCCCCC[C@@H](C(N)=O)NC(=O)[C@H](Cc2cc3ccccc3[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3N(C2)C(=O)[C@H](Cc2cnc[nH]2)NC1=O
    InChI
    InChI=1S/C51H66N12O9/c1-3-4-15-38(56-30(2)64)46(67)59-40-26-44(65)54-20-11-5-6-17-37(45(52)66)58-47(68)39(24-34-23-31-13-7-9-16-36(31)57-34)60-49(70)43-19-12-21-62(43)50(71)33-22-32-14-8-10-18-42(32)63(28-33)51(72)41(61-48(40)69)25-35-27-53-29-55-35/h7-10,13-14,16,18,23,27,29,33,37-41,43,57H,3-6,11-12,15,17,19-22,24-26,28H2,1-2H3,(H2,52,66)(H,53,55)(H,54,65)(H,56,64)(H,58,68)(H,59,67)(H,60,70)(H,61,69)/t33-,37+,38+,39+,40?,41+,43+/m1/s1
    MOLECULAR FORMULA
    C51H66N12O9
    CROSS REFERENCES
    Loading...
    canSAR821176
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight990.51
    AlogP1.07
    HBond donors10
    HBond acceptors21
    Atoms138
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR821176.