Drug Information

Drug ID:  NPD5155
Drug Name:  Phenazocine Hydrobromide
Molecular Formula:  C22H27NO.BrH
Canonical SMILES:  Oc1ccc2c(c1)C1(C)CCN(C(C2)C1C)CCc1ccccc1.Br
Standard InCHI:  InChI=1S/C22H27NO.BrH/c1-16-21-14-18-8-9-19(24)15-20(18)22(16,2)11-13-23(21)12-10-17-6-4-3-5-7-17;/h3-9,15-16,21,24H,10-14H2,1-2H3;1H
Standard InCHIKey:  MNMGNPZLUMHSKK-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD5155

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 NPC259665
High Similarity 1.0 NPC126859
High Similarity 1.0 NPC89769
High Similarity 0.9756 NPC124802
High Similarity 0.9675 NPC66177
High Similarity 0.9675 NPC8305
High Similarity 0.9675 NPC268763
High Similarity 0.937 NPC149379
High Similarity 0.8855 NPC325568
Intermediate Similarity 0.8168 NPC307020
Intermediate Similarity 0.8143 NPC470925
Intermediate Similarity 0.8049 NPC11554
Intermediate Similarity 0.8 NPC322753
Intermediate Similarity 0.7953 NPC195922
Intermediate Similarity 0.792 NPC141782
Intermediate Similarity 0.7857 NPC260323
Intermediate Similarity 0.7857 NPC176279
Intermediate Similarity 0.7829 NPC166014
Intermediate Similarity 0.7829 NPC27410
Intermediate Similarity 0.7795 NPC250323
Intermediate Similarity 0.7785 NPC26601
Intermediate Similarity 0.7778 NPC13482
Intermediate Similarity 0.7746 NPC170170
Intermediate Similarity 0.7746 NPC211468
Intermediate Similarity 0.7746 NPC219233
Intermediate Similarity 0.7734 NPC715
Intermediate Similarity 0.7727 NPC1229
Intermediate Similarity 0.7717 NPC95716
Intermediate Similarity 0.7692 NPC323123
Intermediate Similarity 0.7692 NPC471668
Intermediate Similarity 0.7674 NPC268160
Intermediate Similarity 0.7671 NPC185838
Intermediate Similarity 0.7656 NPC46940
Intermediate Similarity 0.7623 NPC155847
Intermediate Similarity 0.7623 NPC289381
Intermediate Similarity 0.7615 NPC192948
Intermediate Similarity 0.7615 NPC147179
Intermediate Similarity 0.7615 NPC35797
Intermediate Similarity 0.7613 NPC324144
Intermediate Similarity 0.76 NPC326316
Intermediate Similarity 0.76 NPC81733
Intermediate Similarity 0.758 NPC205421
Intermediate Similarity 0.758 NPC81218
Intermediate Similarity 0.758 NPC117188
Intermediate Similarity 0.758 NPC306555
Intermediate Similarity 0.758 NPC12053
Intermediate Similarity 0.758 NPC158376
Intermediate Similarity 0.758 NPC298979
Intermediate Similarity 0.758 NPC474931
Intermediate Similarity 0.758 NPC145832
Intermediate Similarity 0.7578 NPC77772
Intermediate Similarity 0.7576 NPC164649
Intermediate Similarity 0.7576 NPC48342
Intermediate Similarity 0.7568 NPC321505
Intermediate Similarity 0.7568 NPC191376
Intermediate Similarity 0.7568 NPC476151
Intermediate Similarity 0.7568 NPC179825
Intermediate Similarity 0.7564 NPC13504
Intermediate Similarity 0.7564 NPC96603
Intermediate Similarity 0.7564 NPC477563
Intermediate Similarity 0.7564 NPC78222
Intermediate Similarity 0.7564 NPC253043
Intermediate Similarity 0.7564 NPC212794
Intermediate Similarity 0.7564 NPC306843
Intermediate Similarity 0.7564 NPC136508
Intermediate Similarity 0.7564 NPC196447
Intermediate Similarity 0.7559 NPC58865
Intermediate Similarity 0.7557 NPC219112
Intermediate Similarity 0.7557 NPC308828
Intermediate Similarity 0.7557 NPC308311
Intermediate Similarity 0.7557 NPC477137
Intermediate Similarity 0.7557 NPC38893
Intermediate Similarity 0.754 NPC151477
Intermediate Similarity 0.7532 NPC221864
Intermediate Similarity 0.7519 NPC42657
Intermediate Similarity 0.7519 NPC93071
Intermediate Similarity 0.7519 NPC126002
Intermediate Similarity 0.7517 NPC476571
Intermediate Similarity 0.7517 NPC246587
Intermediate Similarity 0.7517 NPC24233
Intermediate Similarity 0.7517 NPC147390
Intermediate Similarity 0.7517 NPC135538
Intermediate Similarity 0.7517 NPC428
Intermediate Similarity 0.7516 NPC35627
Intermediate Similarity 0.7516 NPC81247
Intermediate Similarity 0.7516 NPC476573
Intermediate Similarity 0.75 NPC257390
Intermediate Similarity 0.75 NPC150712
Intermediate Similarity 0.75 NPC16030
Intermediate Similarity 0.75 NPC477136
Intermediate Similarity 0.75 NPC304510
Intermediate Similarity 0.75 NPC172219
Intermediate Similarity 0.7484 NPC226428
Intermediate Similarity 0.7484 NPC271388
Intermediate Similarity 0.7484 NPC119649
Intermediate Similarity 0.7484 NPC235143
Intermediate Similarity 0.7484 NPC205255
Intermediate Similarity 0.7484 NPC230956
Intermediate Similarity 0.7481 NPC109151
Intermediate Similarity 0.748 NPC211885
Intermediate Similarity 0.7468 NPC79328
Intermediate Similarity 0.7467 NPC477565
Intermediate Similarity 0.7467 NPC103379
Intermediate Similarity 0.7463 NPC321133
Intermediate Similarity 0.7463 NPC318552
Intermediate Similarity 0.7463 NPC99734
Intermediate Similarity 0.7463 NPC190501
Intermediate Similarity 0.7462 NPC322239
Intermediate Similarity 0.7462 NPC321589
Intermediate Similarity 0.746 NPC271274
Intermediate Similarity 0.7459 NPC225464
Intermediate Similarity 0.7453 NPC329969
Intermediate Similarity 0.7452 NPC255607
Intermediate Similarity 0.7452 NPC3375
Intermediate Similarity 0.745 NPC90844
Intermediate Similarity 0.745 NPC253883
Intermediate Similarity 0.745 NPC144863
Intermediate Similarity 0.745 NPC95075
Intermediate Similarity 0.7444 NPC471671
Intermediate Similarity 0.7444 NPC469609
Intermediate Similarity 0.7442 NPC266937
Intermediate Similarity 0.7442 NPC470770
Intermediate Similarity 0.7436 NPC80759
Intermediate Similarity 0.7436 NPC79402
Intermediate Similarity 0.7431 NPC193528
Intermediate Similarity 0.7424 NPC82963
Intermediate Similarity 0.7424 NPC469663
Intermediate Similarity 0.7424 NPC92
Intermediate Similarity 0.7424 NPC141001
Intermediate Similarity 0.7422 NPC65855
Intermediate Similarity 0.7422 NPC314187
Intermediate Similarity 0.7422 NPC292758
Intermediate Similarity 0.7417 NPC192768
Intermediate Similarity 0.7417 NPC151895
Intermediate Similarity 0.7417 NPC88249
Intermediate Similarity 0.7417 NPC97221
Intermediate Similarity 0.7417 NPC220858
Intermediate Similarity 0.7407 NPC328504
Intermediate Similarity 0.7405 NPC124657
Intermediate Similarity 0.7405 NPC471534
Intermediate Similarity 0.7403 NPC186063
Intermediate Similarity 0.7398 NPC92730
Intermediate Similarity 0.7394 NPC132847
Intermediate Similarity 0.7388 NPC469644
Intermediate Similarity 0.7385 NPC177962
Intermediate Similarity 0.7385 NPC62867
Intermediate Similarity 0.7381 NPC117115
Intermediate Similarity 0.7375 NPC168753
Intermediate Similarity 0.7375 NPC118274
Intermediate Similarity 0.7372 NPC475780
Intermediate Similarity 0.7368 NPC299180
Intermediate Similarity 0.7368 NPC311737
Intermediate Similarity 0.7368 NPC38458
Intermediate Similarity 0.7364 NPC474149
Intermediate Similarity 0.7355 NPC476572
Intermediate Similarity 0.7353 NPC77569
Intermediate Similarity 0.7353 NPC142198
Intermediate Similarity 0.7351 NPC219162
Intermediate Similarity 0.7351 NPC207824
Intermediate Similarity 0.7351 NPC92541
Intermediate Similarity 0.7351 NPC60538
Intermediate Similarity 0.7348 NPC469719
Intermediate Similarity 0.7344 NPC96224
Intermediate Similarity 0.7344 NPC24101
Intermediate Similarity 0.7342 NPC134858
Intermediate Similarity 0.7338 NPC5238
Intermediate Similarity 0.7338 NPC204828
Intermediate Similarity 0.7338 NPC39701
Intermediate Similarity 0.7338 NPC193949
Intermediate Similarity 0.7338 NPC110416
Intermediate Similarity 0.7338 NPC325871
Intermediate Similarity 0.7338 NPC54379
Intermediate Similarity 0.7338 NPC295691
Intermediate Similarity 0.7338 NPC127674
Intermediate Similarity 0.7338 NPC99659
Intermediate Similarity 0.7338 NPC2413
Intermediate Similarity 0.7338 NPC469817
Intermediate Similarity 0.7338 NPC189266
Intermediate Similarity 0.7338 NPC278799
Intermediate Similarity 0.7338 NPC207757
Intermediate Similarity 0.7338 NPC276588
Intermediate Similarity 0.7338 NPC249797
Intermediate Similarity 0.7338 NPC184026
Intermediate Similarity 0.7338 NPC172765
Intermediate Similarity 0.7333 NPC260832
Intermediate Similarity 0.7333 NPC135467
Intermediate Similarity 0.7329 NPC314682
Intermediate Similarity 0.7329 NPC239775
Intermediate Similarity 0.7324 NPC300020
Intermediate Similarity 0.7324 NPC302171
Intermediate Similarity 0.7324 NPC33338
Intermediate Similarity 0.7323 NPC21594
Intermediate Similarity 0.7317 NPC32674
Intermediate Similarity 0.7308 NPC151537
Intermediate Similarity 0.7299 NPC176208
Intermediate Similarity 0.7293 NPC474358
Intermediate Similarity 0.7293 NPC474387
Intermediate Similarity 0.7293 NPC137496
Intermediate Similarity 0.7293 NPC154511
Intermediate Similarity 0.7293 NPC247858

Drug Structure

External Identifiers

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

Drug Properties

Molecular Weight  321.21
ALogP  0.5049
MLogP  3.66
XLogP  6.578
HDA  1
HBD  1
Rotatable Bonds  6
TPSA  23.47
RO5 Violation  1