Drug Information

Drug ID:  NPD5175
Drug Name:  Flumethasone
Molecular Formula:  C22H28F2O5
Canonical SMILES:  OCC(=O)[C@@]1(O)[C@H](C)C[C@@H]2[C@]1(C)C[C@H](O)[C@]1([C@H]2C[C@@H](C2=CC(=O)C=C[C@]12C)F)F
Standard InCHI:  InChI=1S/C22H28F2O5/c1-11-6-13-14-8-16(23)15-7-12(26)4-5-19(15,2)21(14,24)17(27)9-20(13,3)22(11,29)18(28)10-25/h4-5,7,11,13-14,16-17,25,27,29H,6,8-10H2,1-3H3/t11-,13+,14+,16+,17+,19+,20+,21+,22+/m1/s1
Standard InCHIKey:  WXURHACBFYSXBI-GQKYHHCASA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  DrugBank

  Structural Similarity Between NPASS Natural Products and NPD5175

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 0.9684 NPC144956
High Similarity 0.9474 NPC18509
High Similarity 0.9307 NPC2766
High Similarity 0.9216 NPC235077
High Similarity 0.9109 NPC44063
High Similarity 0.8947 NPC168027
High Similarity 0.8947 NPC185936
High Similarity 0.8812 NPC311612
High Similarity 0.875 NPC214644
High Similarity 0.8738 NPC185
High Similarity 0.8737 NPC326627
High Similarity 0.8737 NPC310010
High Similarity 0.8713 NPC87351
High Similarity 0.8632 NPC328539
High Similarity 0.8586 NPC192428
High Similarity 0.8586 NPC49371
High Similarity 0.8571 NPC111015
High Similarity 0.8544 NPC137657
High Similarity 0.8515 NPC15390
High Similarity 0.8515 NPC474720
Intermediate Similarity 0.8482 NPC313528
Intermediate Similarity 0.8469 NPC233118
Intermediate Similarity 0.8462 NPC257353
Intermediate Similarity 0.8447 NPC191892
Intermediate Similarity 0.8447 NPC111323
Intermediate Similarity 0.8421 NPC327115
Intermediate Similarity 0.8416 NPC114274
Intermediate Similarity 0.84 NPC249954
Intermediate Similarity 0.8384 NPC196485
Intermediate Similarity 0.8384 NPC245972
Intermediate Similarity 0.8381 NPC83744
Intermediate Similarity 0.8367 NPC272746
Intermediate Similarity 0.8365 NPC235889
Intermediate Similarity 0.8351 NPC477943
Intermediate Similarity 0.8351 NPC474245
Intermediate Similarity 0.8351 NPC86319
Intermediate Similarity 0.8351 NPC275740
Intermediate Similarity 0.8351 NPC76879
Intermediate Similarity 0.8351 NPC31985
Intermediate Similarity 0.8351 NPC1015
Intermediate Similarity 0.835 NPC477915
Intermediate Similarity 0.835 NPC473424
Intermediate Similarity 0.8333 NPC71348
Intermediate Similarity 0.8333 NPC154072
Intermediate Similarity 0.8317 NPC190554
Intermediate Similarity 0.8302 NPC329417
Intermediate Similarity 0.83 NPC259286
Intermediate Similarity 0.83 NPC473170
Intermediate Similarity 0.83 NPC472824
Intermediate Similarity 0.8286 NPC50692
Intermediate Similarity 0.8286 NPC49958
Intermediate Similarity 0.8286 NPC260268
Intermediate Similarity 0.8286 NPC202167
Intermediate Similarity 0.8286 NPC302607
Intermediate Similarity 0.8286 NPC476027
Intermediate Similarity 0.8286 NPC152695
Intermediate Similarity 0.8286 NPC48733
Intermediate Similarity 0.8286 NPC296945
Intermediate Similarity 0.8286 NPC85829
Intermediate Similarity 0.8286 NPC171137
Intermediate Similarity 0.8286 NPC150531
Intermediate Similarity 0.8286 NPC214264
Intermediate Similarity 0.8286 NPC319077
Intermediate Similarity 0.8286 NPC97202
Intermediate Similarity 0.8286 NPC181265
Intermediate Similarity 0.8283 NPC474807
Intermediate Similarity 0.8283 NPC475255
Intermediate Similarity 0.8269 NPC249187
Intermediate Similarity 0.8269 NPC117185
Intermediate Similarity 0.8269 NPC247957
Intermediate Similarity 0.8265 NPC171441
Intermediate Similarity 0.8257 NPC73300
Intermediate Similarity 0.8257 NPC108721
Intermediate Similarity 0.8247 NPC131470
Intermediate Similarity 0.8247 NPC143767
Intermediate Similarity 0.8235 NPC147954
Intermediate Similarity 0.8229 NPC20688
Intermediate Similarity 0.8218 NPC305483
Intermediate Similarity 0.8218 NPC96859
Intermediate Similarity 0.8218 NPC328162
Intermediate Similarity 0.8218 NPC477853
Intermediate Similarity 0.8211 NPC329043
Intermediate Similarity 0.8211 NPC237712
Intermediate Similarity 0.8211 NPC58841
Intermediate Similarity 0.8211 NPC321187
Intermediate Similarity 0.8211 NPC161423
Intermediate Similarity 0.8211 NPC227064
Intermediate Similarity 0.8211 NPC144258
Intermediate Similarity 0.8208 NPC43285
Intermediate Similarity 0.8208 NPC477916
Intermediate Similarity 0.8208 NPC165873
Intermediate Similarity 0.8208 NPC58370
Intermediate Similarity 0.8208 NPC220229
Intermediate Similarity 0.8208 NPC475060
Intermediate Similarity 0.82 NPC8993
Intermediate Similarity 0.8198 NPC471854
Intermediate Similarity 0.819 NPC204833
Intermediate Similarity 0.819 NPC209502
Intermediate Similarity 0.8182 NPC472978
Intermediate Similarity 0.8182 NPC475806
Intermediate Similarity 0.8182 NPC99380
Intermediate Similarity 0.8173 NPC22388
Intermediate Similarity 0.8165 NPC475524
Intermediate Similarity 0.8165 NPC100267
Intermediate Similarity 0.8163 NPC119416
Intermediate Similarity 0.8155 NPC83709
Intermediate Similarity 0.8148 NPC197428
Intermediate Similarity 0.8144 NPC475740
Intermediate Similarity 0.8144 NPC58063
Intermediate Similarity 0.8137 NPC108078
Intermediate Similarity 0.8131 NPC217201
Intermediate Similarity 0.8131 NPC65941
Intermediate Similarity 0.8131 NPC177064
Intermediate Similarity 0.8125 NPC311554
Intermediate Similarity 0.8125 NPC470574
Intermediate Similarity 0.8125 NPC257457
Intermediate Similarity 0.8125 NPC36350
Intermediate Similarity 0.8119 NPC280725
Intermediate Similarity 0.8119 NPC472485
Intermediate Similarity 0.8119 NPC474602
Intermediate Similarity 0.8119 NPC180950
Intermediate Similarity 0.8119 NPC472932
Intermediate Similarity 0.8113 NPC60681
Intermediate Similarity 0.8113 NPC149047
Intermediate Similarity 0.8108 NPC270958
Intermediate Similarity 0.8105 NPC64600
Intermediate Similarity 0.81 NPC12722
Intermediate Similarity 0.81 NPC472930
Intermediate Similarity 0.81 NPC470376
Intermediate Similarity 0.81 NPC470375
Intermediate Similarity 0.81 NPC69454
Intermediate Similarity 0.8091 NPC194100
Intermediate Similarity 0.8081 NPC320026
Intermediate Similarity 0.8081 NPC191684
Intermediate Similarity 0.8081 NPC129913
Intermediate Similarity 0.8081 NPC183283
Intermediate Similarity 0.8081 NPC126993
Intermediate Similarity 0.8081 NPC85173
Intermediate Similarity 0.8077 NPC302537
Intermediate Similarity 0.8077 NPC163372
Intermediate Similarity 0.8073 NPC43775
Intermediate Similarity 0.8073 NPC207689
Intermediate Similarity 0.8061 NPC158778
Intermediate Similarity 0.8061 NPC470417
Intermediate Similarity 0.8061 NPC292491
Intermediate Similarity 0.8061 NPC471941
Intermediate Similarity 0.8061 NPC310752
Intermediate Similarity 0.8061 NPC471722
Intermediate Similarity 0.8058 NPC191565
Intermediate Similarity 0.8058 NPC477854
Intermediate Similarity 0.8056 NPC258543
Intermediate Similarity 0.8056 NPC241927
Intermediate Similarity 0.8056 NPC11710
Intermediate Similarity 0.8056 NPC470257
Intermediate Similarity 0.8041 NPC51014
Intermediate Similarity 0.8041 NPC474778
Intermediate Similarity 0.8041 NPC474733
Intermediate Similarity 0.8041 NPC72133
Intermediate Similarity 0.8041 NPC145879
Intermediate Similarity 0.8041 NPC474732
Intermediate Similarity 0.8041 NPC94666
Intermediate Similarity 0.8041 NPC31564
Intermediate Similarity 0.8037 NPC475294
Intermediate Similarity 0.8021 NPC82902
Intermediate Similarity 0.8021 NPC214043
Intermediate Similarity 0.8021 NPC85774
Intermediate Similarity 0.802 NPC103527
Intermediate Similarity 0.802 NPC299100
Intermediate Similarity 0.802 NPC166906
Intermediate Similarity 0.802 NPC473172
Intermediate Similarity 0.802 NPC471207
Intermediate Similarity 0.8019 NPC29705
Intermediate Similarity 0.8019 NPC149124
Intermediate Similarity 0.8019 NPC72255
Intermediate Similarity 0.8019 NPC75531
Intermediate Similarity 0.8 NPC131872
Intermediate Similarity 0.8 NPC473998
Intermediate Similarity 0.8 NPC63748
Intermediate Similarity 0.8 NPC185530
Intermediate Similarity 0.8 NPC308726
Intermediate Similarity 0.8 NPC119601
Intermediate Similarity 0.8 NPC193347
Intermediate Similarity 0.8 NPC155304
Intermediate Similarity 0.8 NPC207251
Intermediate Similarity 0.7981 NPC112167
Intermediate Similarity 0.7981 NPC110149
Intermediate Similarity 0.798 NPC472973
Intermediate Similarity 0.798 NPC473999
Intermediate Similarity 0.798 NPC475921
Intermediate Similarity 0.798 NPC474704
Intermediate Similarity 0.798 NPC309603
Intermediate Similarity 0.798 NPC186688
Intermediate Similarity 0.798 NPC2983
Intermediate Similarity 0.798 NPC32830
Intermediate Similarity 0.7965 NPC118638
Intermediate Similarity 0.7963 NPC94529
Intermediate Similarity 0.7961 NPC43747
Intermediate Similarity 0.7959 NPC317590
Intermediate Similarity 0.7959 NPC93778
Intermediate Similarity 0.7959 NPC141292

Drug Structure

External Identifiers

TTD   DAP000814
DrugBank   DB00663
ChEMBL   CHEMBL1201392
IUPHAR/BPS  
PharmaGKB   PA164749388
KEGG Drug   D04208
PubChem CID  
ChEBI   34764
CAS Number  2135-17-3

Drug Properties

Molecular Weight  410.19
ALogP  -0.5771
MLogP  3.11
XLogP  1.067
HDA  5
HBD  3
Rotatable Bonds  10
TPSA  94.83
RO5 Violation  0