Drug Information

Drug ID:  NPD8594
Drug Name:  Succinic acid
Molecular Formula:  C4H6O4
Canonical SMILES:  OC(=O)CCC(=O)O
Standard InCHI:  InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
Standard InCHIKey:  KDYFGRWQOYBRFD-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  TTD; DrugBank

  Structural Similarity Between NPASS Natural Products and NPD8594

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.


  Similar Natural Products

High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7

Similarity Level Similarity Score Natural Product ID
High Similarity 1.0 NPC236709
Intermediate Similarity 0.8 NPC198126
Intermediate Similarity 0.7879 NPC1037
Intermediate Similarity 0.7857 NPC149209
Intermediate Similarity 0.7667 NPC180423
Intermediate Similarity 0.7647 NPC321569
Intermediate Similarity 0.7273 NPC7814
Intermediate Similarity 0.7143 NPC317945
Intermediate Similarity 0.7097 NPC122768
Intermediate Similarity 0.7097 NPC292641
Intermediate Similarity 0.7097 NPC104195
Intermediate Similarity 0.7097 NPC151140
Intermediate Similarity 0.7097 NPC174368
Intermediate Similarity 0.7097 NPC61066
Intermediate Similarity 0.7059 NPC316685
Intermediate Similarity 0.7037 NPC181153
Intermediate Similarity 0.7027 NPC240109
Intermediate Similarity 0.7 NPC283626
Remote Similarity 0.697 NPC328710
Remote Similarity 0.697 NPC18224
Remote Similarity 0.697 NPC125575
Remote Similarity 0.697 NPC108238
Remote Similarity 0.6944 NPC128713
Remote Similarity 0.6875 NPC320981
Remote Similarity 0.6842 NPC19044
Remote Similarity 0.6842 NPC24751
Remote Similarity 0.6842 NPC100742
Remote Similarity 0.6842 NPC97444
Remote Similarity 0.6842 NPC121018
Remote Similarity 0.6842 NPC192402
Remote Similarity 0.6667 NPC3343
Remote Similarity 0.6667 NPC314668
Remote Similarity 0.6667 NPC280532
Remote Similarity 0.6667 NPC230726
Remote Similarity 0.6667 NPC169098
Remote Similarity 0.6562 NPC248139
Remote Similarity 0.6471 NPC175342
Remote Similarity 0.641 NPC35661
Remote Similarity 0.6389 NPC134782
Remote Similarity 0.6364 NPC16947
Remote Similarity 0.6364 NPC241404
Remote Similarity 0.6341 NPC285322
Remote Similarity 0.6341 NPC208793
Remote Similarity 0.6333 NPC28246
Remote Similarity 0.6286 NPC127142
Remote Similarity 0.6286 NPC307027
Remote Similarity 0.625 NPC289686
Remote Similarity 0.625 NPC234005
Remote Similarity 0.6216 NPC206924
Remote Similarity 0.6176 NPC328569
Remote Similarity 0.6129 NPC259649
Remote Similarity 0.6129 NPC286233
Remote Similarity 0.6111 NPC250870
Remote Similarity 0.6111 NPC317203
Remote Similarity 0.6111 NPC191084
Remote Similarity 0.6111 NPC168052
Remote Similarity 0.6053 NPC325454
Remote Similarity 0.6053 NPC268826
Remote Similarity 0.5952 NPC242655
Remote Similarity 0.5952 NPC38891
Remote Similarity 0.5946 NPC5505
Remote Similarity 0.5946 NPC155263
Remote Similarity 0.5938 NPC320704
Remote Similarity 0.5938 NPC143211
Remote Similarity 0.5926 NPC68873
Remote Similarity 0.5909 NPC227850
Remote Similarity 0.5897 NPC183424
Remote Similarity 0.5897 NPC214610
Remote Similarity 0.5897 NPC118968
Remote Similarity 0.5897 NPC294085
Remote Similarity 0.5789 NPC158179
Remote Similarity 0.5789 NPC109026
Remote Similarity 0.5789 NPC252843
Remote Similarity 0.5778 NPC137419
Remote Similarity 0.5778 NPC122212
Remote Similarity 0.5778 NPC293378
Remote Similarity 0.5714 NPC43264
Remote Similarity 0.5714 NPC212144
Remote Similarity 0.5667 NPC203105
Remote Similarity 0.5667 NPC8187
Remote Similarity 0.5641 NPC38930
Remote Similarity 0.5641 NPC73245
Remote Similarity 0.5641 NPC18188
Remote Similarity 0.5625 NPC166804

Drug Structure

External Identifiers

TTD   DIB005716; DAP000545
DrugBank   DB00139
ChEMBL   CHEMBL576
IUPHAR/BPS  
PharmaGKB   PA164747739
KEGG Drug  
PubChem CID   1110
ChEBI   15741
CAS Number  110-15-6

Drug Properties

Molecular Weight  118.03
ALogP  -0.41
MLogP  1.46
XLogP  -0.71
HDA  4
HBD  2
Rotatable Bonds  5
TPSA  74.6
RO5 Violation  0