Natural Product: NPC15127

Natural Product ID:  NPC15127
Common Name:   2-Hydroxyestrone
IUPAC Name:   (8R,9S,13S,14S)-2,3-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Synonyms:   2-Hydroxyestrone
Molecular Formula:   C18H22O3
Standard InCHIKey:  SWINWPBPEKHUOD-JPVZDGGYSA-N
Standard InCHI:  InChI=1S/C18H22O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,19-20H,2-7H2,1H3/t11-,12+,14-,18-/m0/s1
Canonical SMILES:  O=C1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCc2c1cc(O)c(c2)O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO1797 Homo sapiens Species Hominidae Eukaryota DOI[10.1038/nbt.2488]
NPO1797 Homo sapiens Species Hominidae Eukaryota urine PMID[8478958]
NPO1797 Homo sapiens Species Hominidae Eukaryota blood PMID[663967]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT901 Individual Protein UDP-glucuronosyltransferase 1-1 Homo sapiens Activity = 58 pm/min/mg 10836148
NPT901 Individual Protein UDP-glucuronosyltransferase 1-1 Homo sapiens Activity = 341 pm/min/mg 10836148
NPT699 Individual Protein UDP-glucuronosyltransferase 1-10 Homo sapiens Activity = 23 pm/min/mg 10836148
NPT694 Individual Protein UDP-glucuronosyltransferase 1-3 Homo sapiens Activity = 223 pm/min/mg 10836148
NPT902 Individual Protein UDP-glucuronosyltransferase 1A4 Homo sapiens Activity = 0 pm/min/mg 10836148
NPT695 Individual Protein UDP-glucuronosyltransferase 1-8 Homo sapiens Activity = 208 pm/min/mg 10836148
NPT695 Individual Protein UDP-glucuronosyltransferase 1-8 Homo sapiens Activity = 277 pm/min/mg 10836148
NPT704 Individual Protein UDP-glucuronosyltransferase 2B15 Homo sapiens Activity = 3.3 pm/min/mg 10836148
NPT701 Individual Protein UDP-glucuronosyltransferase 2B4 Homo sapiens Activity = 0 pm/min/mg 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 5 pm/min/mg 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 1 total picomoles 10836148
NPT697 Individual Protein UDP-glucuronosyltransferase 2B7 Homo sapiens Activity = 0.15 total picomoles 10836148

  Similar Natural Products in NPASS

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

●  The left chart: Distribution of similarity level between NPC15127 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
0.9407 High Similarity NPC318552
0.9407 High Similarity NPC190501
0.9141 High Similarity NPC252343
0.9 High Similarity NPC31296
0.9 High Similarity NPC258366
0.9 High Similarity NPC79933
0.9 High Similarity NPC473974
0.8862 High Similarity NPC321402
0.8843 High Similarity NPC42657
0.881 High Similarity NPC262936
0.881 High Similarity NPC30491
0.8699 High Similarity NPC259703
0.8699 High Similarity NPC21216
0.8699 High Similarity NPC32322
0.8692 High Similarity NPC111845
0.8682 High Similarity NPC291001
0.8682 High Similarity NPC243305
0.8678 High Similarity NPC16030
0.8644 High Similarity NPC322753
0.864 High Similarity NPC471187
0.8629 High Similarity NPC249340
0.8629 High Similarity NPC154696
0.8629 High Similarity NPC162935
0.8571 High Similarity NPC181334
0.8561 High Similarity NPC43353
0.8561 High Similarity NPC153088
0.8561 High Similarity NPC103082
0.856 High Similarity NPC176208
0.856 High Similarity NPC11250
0.855 High Similarity NPC476282
0.855 High Similarity NPC138472
0.8492 Intermediate Similarity NPC198014
0.8485 Intermediate Similarity NPC293454
0.848 Intermediate Similarity NPC253627
0.8438 Intermediate Similarity NPC269598
0.8433 Intermediate Similarity NPC277559
0.8433 Intermediate Similarity NPC49911
0.8433 Intermediate Similarity NPC471152
0.8425 Intermediate Similarity NPC471927
0.8409 Intermediate Similarity NPC4170
0.84 Intermediate Similarity NPC241001
0.8372 Intermediate Similarity NPC69424
0.8372 Intermediate Similarity NPC176130
0.8372 Intermediate Similarity NPC78364
0.8372 Intermediate Similarity NPC84672
0.837 Intermediate Similarity NPC471974
0.837 Intermediate Similarity NPC469680
0.837 Intermediate Similarity NPC469681
0.8359 Intermediate Similarity NPC87985
0.8359 Intermediate Similarity NPC137750
0.8358 Intermediate Similarity NPC7464
0.8347 Intermediate Similarity NPC317869
0.8333 Intermediate Similarity NPC77569
0.8333 Intermediate Similarity NPC142198
0.8308 Intermediate Similarity NPC234175
0.8306 Intermediate Similarity NPC48342
0.8306 Intermediate Similarity NPC164649
0.8296 Intermediate Similarity NPC476393
0.8293 Intermediate Similarity NPC277394
0.8293 Intermediate Similarity NPC61062
0.8293 Intermediate Similarity NPC299252
0.8268 Intermediate Similarity NPC471794
0.8268 Intermediate Similarity NPC121168
0.8264 Intermediate Similarity NPC471179
0.8254 Intermediate Similarity NPC98305
0.8248 Intermediate Similarity NPC471853
0.8248 Intermediate Similarity NPC470035
0.8244 Intermediate Similarity NPC276238
0.8235 Intermediate Similarity NPC91887
0.8235 Intermediate Similarity NPC51531
0.8235 Intermediate Similarity NPC114333
0.8235 Intermediate Similarity NPC50615
0.8235 Intermediate Similarity NPC5014
0.8235 Intermediate Similarity NPC149773
0.8235 Intermediate Similarity NPC157284
0.8235 Intermediate Similarity NPC11554
0.8235 Intermediate Similarity NPC46242
0.8235 Intermediate Similarity NPC165191
0.8235 Intermediate Similarity NPC297797
0.8235 Intermediate Similarity NPC477849
0.8235 Intermediate Similarity NPC28592
0.8235 Intermediate Similarity NPC289358
0.8235 Intermediate Similarity NPC473779
0.8235 Intermediate Similarity NPC473479
0.8235 Intermediate Similarity NPC245760
0.8235 Intermediate Similarity NPC23667
0.8235 Intermediate Similarity NPC42384
0.8235 Intermediate Similarity NPC230811
0.8235 Intermediate Similarity NPC469857
0.8231 Intermediate Similarity NPC72667
0.822 Intermediate Similarity NPC477814
0.8214 Intermediate Similarity NPC8102
0.8214 Intermediate Similarity NPC66894
0.8209 Intermediate Similarity NPC471913
0.8195 Intermediate Similarity NPC321502
0.8182 Intermediate Similarity NPC108129
0.8182 Intermediate Similarity NPC260323
0.8182 Intermediate Similarity NPC176279
0.8175 Intermediate Similarity NPC99734
0.8175 Intermediate Similarity NPC294330
0.8175 Intermediate Similarity NPC34634
0.8175 Intermediate Similarity NPC478121
0.8175 Intermediate Similarity NPC265454
0.8167 Intermediate Similarity NPC228343
0.8167 Intermediate Similarity NPC254833
0.8154 Intermediate Similarity NPC254492
0.8154 Intermediate Similarity NPC71610
0.814 Intermediate Similarity NPC199273
0.8129 Intermediate Similarity NPC248068
0.8129 Intermediate Similarity NPC184935
0.812 Intermediate Similarity NPC471851
0.8116 Intermediate Similarity NPC473527
0.8116 Intermediate Similarity NPC29599
0.8116 Intermediate Similarity NPC476534
0.811 Intermediate Similarity NPC328504
0.8106 Intermediate Similarity NPC303910
0.8106 Intermediate Similarity NPC171460
0.8099 Intermediate Similarity NPC141782
0.8071 Intermediate Similarity NPC224884
0.8071 Intermediate Similarity NPC199936
0.8071 Intermediate Similarity NPC209085
0.8065 Intermediate Similarity NPC469719
0.8065 Intermediate Similarity NPC35797
0.8065 Intermediate Similarity NPC192948
0.8051 Intermediate Similarity NPC120719
0.8016 Intermediate Similarity NPC328694
0.8014 Intermediate Similarity NPC126707
0.8014 Intermediate Similarity NPC309169
0.8014 Intermediate Similarity NPC196941
0.8 Intermediate Similarity NPC137496
0.8 Intermediate Similarity NPC176030
0.8 Intermediate Similarity NPC141817
0.8 Intermediate Similarity NPC477139
0.8 Intermediate Similarity NPC471972
0.8 Intermediate Similarity NPC308311
0.8 Intermediate Similarity NPC78307
0.8 Intermediate Similarity NPC154511
0.8 Intermediate Similarity NPC477873
0.8 Intermediate Similarity NPC229218
0.8 Intermediate Similarity NPC192597
0.8 Intermediate Similarity NPC469447
0.8 Intermediate Similarity NPC169214
0.8 Intermediate Similarity NPC471668
0.8 Intermediate Similarity NPC471971
0.8 Intermediate Similarity NPC469855
0.8 Intermediate Similarity NPC38893
0.8 Intermediate Similarity NPC474387
0.8 Intermediate Similarity NPC247858
0.8 Intermediate Similarity NPC474358
0.8 Intermediate Similarity NPC30846
0.8 Intermediate Similarity NPC257540
0.8 Intermediate Similarity NPC294226
0.8 Intermediate Similarity NPC477137
0.7986 Intermediate Similarity NPC142654
0.7984 Intermediate Similarity NPC86900
0.7984 Intermediate Similarity NPC195922
0.7984 Intermediate Similarity NPC268160
0.7983 Intermediate Similarity NPC239291
0.797 Intermediate Similarity NPC206028
0.797 Intermediate Similarity NPC30174
0.797 Intermediate Similarity NPC470747
0.7969 Intermediate Similarity NPC474175
0.7969 Intermediate Similarity NPC164852
0.7969 Intermediate Similarity NPC236520
0.7969 Intermediate Similarity NPC294361
0.7967 Intermediate Similarity NPC250323
0.7958 Intermediate Similarity NPC470038
0.7955 Intermediate Similarity NPC476536
0.7953 Intermediate Similarity NPC176893
0.7951 Intermediate Similarity NPC13482
0.7951 Intermediate Similarity NPC222084
0.7943 Intermediate Similarity NPC477207
0.7941 Intermediate Similarity NPC202225
0.7939 Intermediate Similarity NPC228771
0.7939 Intermediate Similarity NPC257589
0.7939 Intermediate Similarity NPC266705
0.7939 Intermediate Similarity NPC29008
0.7939 Intermediate Similarity NPC53305
0.7937 Intermediate Similarity NPC172219
0.7937 Intermediate Similarity NPC304510
0.7929 Intermediate Similarity NPC2681
0.7929 Intermediate Similarity NPC272907
0.7926 Intermediate Similarity NPC165612
0.792 Intermediate Similarity NPC147179
0.7907 Intermediate Similarity NPC201777
0.7907 Intermediate Similarity NPC120545
0.7907 Intermediate Similarity NPC475166
0.7903 Intermediate Similarity NPC148969
0.7902 Intermediate Similarity NPC246229
0.7902 Intermediate Similarity NPC191899
0.7902 Intermediate Similarity NPC273798
0.7899 Intermediate Similarity NPC261573
0.7899 Intermediate Similarity NPC8931
0.7899 Intermediate Similarity NPC120693
0.7895 Intermediate Similarity NPC201069
0.7895 Intermediate Similarity NPC3009
0.7895 Intermediate Similarity NPC96024
0.7887 Intermediate Similarity NPC145301
0.7887 Intermediate Similarity NPC469856
0.7887 Intermediate Similarity NPC294679

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC15127 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.9407 High Similarity NPD3019 Approved
0.9244 High Similarity NPD2932 Approved
0.8699 High Similarity NPD3023 Approved
0.8699 High Similarity NPD3026 Approved
0.8689 High Similarity NPD3025 Approved
0.8689 High Similarity NPD3024 Approved
0.8397 Intermediate Similarity NPD6663 Approved
0.8372 Intermediate Similarity NPD5736 Approved
0.8333 Intermediate Similarity NPD3092 Approved
0.8306 Intermediate Similarity NPD3091 Approved
0.8195 Intermediate Similarity NPD3620 Phase 2
0.8195 Intermediate Similarity NPD3619 Clinical (unspecified phase)
0.8188 Intermediate Similarity NPD8166 Discontinued
0.8175 Intermediate Similarity NPD4059 Approved
0.8167 Intermediate Similarity NPD3021 Approved
0.8167 Intermediate Similarity NPD3022 Approved
0.8077 Intermediate Similarity NPD3094 Phase 2
0.7891 Intermediate Similarity NPD3095 Discontinued
0.7852 Intermediate Similarity NPD8032 Phase 2
0.7746 Intermediate Similarity NPD7910 Clinical (unspecified phase)
0.7634 Intermediate Similarity NPD1201 Approved
0.7586 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7563 Intermediate Similarity NPD3020 Approved
0.7481 Intermediate Similarity NPD4624 Approved
0.7466 Intermediate Similarity NPD3645 Discontinued
0.745 Intermediate Similarity NPD7028 Phase 2
0.741 Intermediate Similarity NPD4140 Approved
0.7407 Intermediate Similarity NPD1470 Approved
0.7405 Intermediate Similarity NPD1651 Approved
0.7373 Intermediate Similarity NPD1432 Clinical (unspecified phase)
0.7357 Intermediate Similarity NPD5735 Approved
0.7333 Intermediate Similarity NPD1283 Approved
0.7324 Intermediate Similarity NPD3299 Clinical (unspecified phase)
0.7311 Intermediate Similarity NPD2860 Approved
0.7311 Intermediate Similarity NPD2859 Approved
0.731 Intermediate Similarity NPD4110 Phase 3
0.731 Intermediate Similarity NPD4109 Clinical (unspecified phase)
0.7297 Intermediate Similarity NPD6273 Approved
0.728 Intermediate Similarity NPD2342 Discontinued
0.7273 Intermediate Similarity NPD4093 Discontinued
0.7273 Intermediate Similarity NPD4196 Clinical (unspecified phase)
0.7266 Intermediate Similarity NPD7635 Approved
0.7259 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7259 Intermediate Similarity NPD5327 Phase 3
0.7234 Intermediate Similarity NPD3657 Discovery
0.7227 Intermediate Similarity NPD2933 Approved
0.7227 Intermediate Similarity NPD2934 Approved
0.7226 Intermediate Similarity NPD257 Approved
0.7226 Intermediate Similarity NPD258 Approved
0.7226 Intermediate Similarity NPD6234 Discontinued
0.7218 Intermediate Similarity NPD1751 Approved
0.7203 Intermediate Similarity NPD7742 Approved
0.7203 Intermediate Similarity NPD7743 Approved
0.7203 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7167 Intermediate Similarity NPD1809 Phase 2
0.7163 Intermediate Similarity NPD943 Approved
0.7154 Intermediate Similarity NPD5951 Approved
0.7153 Intermediate Similarity NPD6100 Approved
0.7153 Intermediate Similarity NPD6099 Approved
0.7132 Intermediate Similarity NPD1755 Approved
0.7124 Intermediate Similarity NPD37 Approved
0.7122 Intermediate Similarity NPD2606 Approved
0.7122 Intermediate Similarity NPD2605 Approved
0.7111 Intermediate Similarity NPD1281 Approved
0.7107 Intermediate Similarity NPD288 Approved
0.7095 Intermediate Similarity NPD3300 Phase 2
0.709 Intermediate Similarity NPD2286 Discontinued
0.708 Intermediate Similarity NPD1876 Approved
0.7075 Intermediate Similarity NPD7003 Approved
0.7073 Intermediate Similarity NPD289 Clinical (unspecified phase)
0.7071 Intermediate Similarity NPD5156 Approved
0.7071 Intermediate Similarity NPD5155 Approved
0.7071 Intermediate Similarity NPD7095 Approved
0.7063 Intermediate Similarity NPD6353 Approved
0.7054 Intermediate Similarity NPD228 Approved
0.705 Intermediate Similarity NPD3636 Approved
0.705 Intermediate Similarity NPD3637 Approved
0.705 Intermediate Similarity NPD3635 Approved
0.7047 Intermediate Similarity NPD7390 Discontinued
0.7045 Intermediate Similarity NPD405 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD826 Approved
0.7042 Intermediate Similarity NPD825 Approved
0.7034 Intermediate Similarity NPD5408 Approved
0.7034 Intermediate Similarity NPD5405 Approved
0.7034 Intermediate Similarity NPD5404 Approved
0.7034 Intermediate Similarity NPD5406 Approved
0.7031 Intermediate Similarity NPD4750 Phase 3
0.7025 Intermediate Similarity NPD844 Approved
0.7025 Intermediate Similarity NPD8127 Discontinued
0.7023 Intermediate Similarity NPD2629 Approved
0.7021 Intermediate Similarity NPD2028 Clinical (unspecified phase)
0.7021 Intermediate Similarity NPD3764 Approved
0.7007 Intermediate Similarity NPD3638 Discontinued
0.7 Intermediate Similarity NPD3595 Approved
0.7 Intermediate Similarity NPD3594 Approved
0.6992 Remote Similarity NPD7610 Discontinued
0.6987 Remote Similarity NPD4966 Approved
0.6987 Remote Similarity NPD4965 Approved
0.6987 Remote Similarity NPD4967 Phase 2
0.6978 Remote Similarity NPD2195 Approved
0.6978 Remote Similarity NPD2194 Approved
0.6966 Remote Similarity NPD651 Clinical (unspecified phase)
0.6947 Remote Similarity NPD5283 Phase 1
0.6944 Remote Similarity NPD4097 Suspended
0.6929 Remote Similarity NPD9569 Approved
0.6923 Remote Similarity NPD4060 Phase 1
0.6914 Remote Similarity NPD7228 Approved
0.6906 Remote Similarity NPD4339 Clinical (unspecified phase)
0.6899 Remote Similarity NPD1792 Phase 2
0.6887 Remote Similarity NPD4160 Clinical (unspecified phase)
0.6884 Remote Similarity NPD3600 Clinical (unspecified phase)
0.6875 Remote Similarity NPD274 Approved
0.6875 Remote Similarity NPD275 Approved
0.6875 Remote Similarity NPD6355 Discontinued
0.687 Remote Similarity NPD9379 Approved
0.687 Remote Similarity NPD9377 Approved
0.686 Remote Similarity NPD845 Approved
0.6853 Remote Similarity NPD259 Phase 1
0.6838 Remote Similarity NPD4626 Approved
0.6838 Remote Similarity NPD7163 Clinical (unspecified phase)
0.6831 Remote Similarity NPD9537 Phase 1
0.6831 Remote Similarity NPD9536 Phase 1
0.6821 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6821 Remote Similarity NPD2421 Approved
0.6821 Remote Similarity NPD2420 Approved
0.6818 Remote Similarity NPD2228 Approved
0.6818 Remote Similarity NPD2229 Approved
0.6818 Remote Similarity NPD2234 Approved
0.6813 Remote Similarity NPD7199 Phase 2
0.6812 Remote Similarity NPD3972 Approved
0.6812 Remote Similarity NPD9269 Phase 2
0.6809 Remote Similarity NPD9494 Approved
0.6806 Remote Similarity NPD2979 Phase 3
0.68 Remote Similarity NPD6190 Approved
0.6786 Remote Similarity NPD3053 Approved
0.6786 Remote Similarity NPD3055 Approved
0.6766 Remote Similarity NPD3534 Clinical (unspecified phase)
0.6759 Remote Similarity NPD555 Phase 2
0.6755 Remote Similarity NPD2422 Clinical (unspecified phase)
0.6752 Remote Similarity NPD2393 Clinical (unspecified phase)
0.6748 Remote Similarity NPD7473 Discontinued
0.6741 Remote Similarity NPD5536 Phase 2
0.6739 Remote Similarity NPD5350 Clinical (unspecified phase)
0.6739 Remote Similarity NPD5351 Clinical (unspecified phase)
0.6733 Remote Similarity NPD6398 Clinical (unspecified phase)
0.673 Remote Similarity NPD7833 Phase 2
0.673 Remote Similarity NPD7831 Phase 2
0.673 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6728 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6725 Remote Similarity NPD2488 Approved
0.6725 Remote Similarity NPD2490 Approved
0.6716 Remote Similarity NPD255 Approved
0.6716 Remote Similarity NPD256 Approved
0.6715 Remote Similarity NPD3412 Clinical (unspecified phase)
0.6714 Remote Similarity NPD5310 Approved
0.6714 Remote Similarity NPD5311 Approved
0.6713 Remote Similarity NPD5952 Clinical (unspecified phase)
0.6713 Remote Similarity NPD3027 Phase 3
0.671 Remote Similarity NPD7458 Discontinued
0.6692 Remote Similarity NPD4869 Clinical (unspecified phase)
0.6691 Remote Similarity NPD1608 Approved
0.669 Remote Similarity NPD2861 Phase 2
0.6689 Remote Similarity NPD2438 Suspended
0.6667 Remote Similarity NPD1242 Phase 1
0.6667 Remote Similarity NPD6232 Discontinued
0.6667 Remote Similarity NPD1693 Approved
0.6667 Remote Similarity NPD6124 Clinical (unspecified phase)
0.6667 Remote Similarity NPD2797 Approved
0.6667 Remote Similarity NPD6798 Discontinued
0.6667 Remote Similarity NPD1164 Approved
0.6667 Remote Similarity NPD1445 Approved
0.6667 Remote Similarity NPD1444 Approved
0.6667 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6645 Remote Similarity NPD3845 Phase 1
0.6644 Remote Similarity NPD4721 Approved
0.6644 Remote Similarity NPD5763 Approved
0.6644 Remote Similarity NPD5762 Approved
0.6644 Remote Similarity NPD2029 Clinical (unspecified phase)
0.6644 Remote Similarity NPD230 Phase 1
0.6644 Remote Similarity NPD4726 Approved
0.6644 Remote Similarity NPD4725 Approved
0.6627 Remote Similarity NPD7090 Clinical (unspecified phase)
0.6623 Remote Similarity NPD4628 Phase 3
0.662 Remote Similarity NPD2798 Approved
0.6617 Remote Similarity NPD7094 Approved
0.6617 Remote Similarity NPD6858 Approved
0.6614 Remote Similarity NPD846 Approved
0.6614 Remote Similarity NPD940 Approved
0.661 Remote Similarity NPD111 Approved
0.6604 Remote Similarity NPD5977 Approved
0.6604 Remote Similarity NPD8438 Clinical (unspecified phase)
0.6604 Remote Similarity NPD5978 Approved
0.6601 Remote Similarity NPD1511 Approved
0.6599 Remote Similarity NPD4579 Clinical (unspecified phase)
0.6596 Remote Similarity NPD6696 Suspended
0.6594 Remote Similarity NPD4589 Approved
0.6593 Remote Similarity NPD4198 Discontinued
0.6591 Remote Similarity NPD9280 Clinical (unspecified phase)
0.6588 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6587 Remote Similarity NPD2066 Phase 3

Structure

External Identifiers

PubChem CID   440623
ChEMBL   CHEMBL1627343
ZINC  

Physicochemical Properties

Molecular Weight:  286.16
ALogP:  -0.3605
MLogP:  3.11
XLogP:  3.294
# Rotatable Bonds:  3
Polar Surface Area:  57.53
# H-Bond Aceptor:  1
# H-Bond Donor:  2
# Rings:  4
# Heavy Atoms:  21

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Biological Activities  
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