Drug Information

Drug ID:  NPD9188
Drug Name:  Sulfaguanidine
Molecular Formula:  C7H10N4O2S
Canonical SMILES:  NC(=N)NS(=O)(=O)c1ccc(cc1)N
Standard InCHI:  InChI=1S/C7H10N4O2S/c8-5-1-3-6(4-2-5)14(12,13)11-7(9)10/h1-4H,8H2,(H4,9,10,11)
Standard InCHIKey:  BRBKOPJOKNSWSG-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD9188

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 0.9432 NPC315403
High Similarity 0.8778 NPC43655
High Similarity 0.8587 NPC107135
Intermediate Similarity 0.7444 NPC301874
Intermediate Similarity 0.7386 NPC271732
Intermediate Similarity 0.7143 NPC66775
Intermediate Similarity 0.7 NPC297532
Remote Similarity 0.6989 NPC35599
Remote Similarity 0.6957 NPC218710
Remote Similarity 0.6699 NPC92689
Remote Similarity 0.6667 NPC134825
Remote Similarity 0.6633 NPC307456
Remote Similarity 0.6569 NPC262295
Remote Similarity 0.6535 NPC229477
Remote Similarity 0.6508 NPC321053
Remote Similarity 0.65 NPC15839
Remote Similarity 0.6442 NPC173991
Remote Similarity 0.6429 NPC328877
Remote Similarity 0.6422 NPC317642
Remote Similarity 0.6381 NPC191444
Remote Similarity 0.6346 NPC111233
Remote Similarity 0.6346 NPC30445
Remote Similarity 0.6339 NPC474430
Remote Similarity 0.6286 NPC176858
Remote Similarity 0.6239 NPC317400
Remote Similarity 0.6204 NPC476483
Remote Similarity 0.6132 NPC240134
Remote Similarity 0.6122 NPC302129
Remote Similarity 0.6111 NPC108800
Remote Similarity 0.6075 NPC78154
Remote Similarity 0.6 NPC328590
Remote Similarity 0.5948 NPC313362
Remote Similarity 0.5847 NPC37584
Remote Similarity 0.5827 NPC473429
Remote Similarity 0.582 NPC314141
Remote Similarity 0.5806 NPC125416
Remote Similarity 0.5789 NPC316435
Remote Similarity 0.5739 NPC70201
Remote Similarity 0.5667 NPC302790
Remote Similarity 0.5652 NPC75496
Remote Similarity 0.5641 NPC311660
Remote Similarity 0.5635 NPC31651
Remote Similarity 0.563 NPC24060
Remote Similarity 0.5612 NPC219246
Remote Similarity 0.5603 NPC326792

Drug Structure

External Identifiers

TTD  
DrugBank  
ChEMBL  
IUPHAR/BPS  
PharmaGKB  
KEGG Drug  
PubChem CID  
ChEBI  
CAS Number  

Drug Properties

Molecular Weight  214.05
ALogP  -1.6446
MLogP  1.46
XLogP  0.233
HDA  6
HBD  4
Rotatable Bonds  5
TPSA  130.44
RO5 Violation  0