Natural Product: NPC26679

Natural Product ID:  NPC26679
Common Name:   Picrasidine B
IUPAC Name:   4,8-dimethoxy-1-(2-methoxyethyl)-9H-pyrido[3,4-b]indole
Synonyms:  
Molecular Formula:   C16H18N2O3
Standard InCHIKey:  VXIBHGSYBDCYKB-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C16H18N2O3/c1-19-8-7-11-16-14(13(21-3)9-17-11)10-5-4-6-12(20-2)15(10)18-16/h4-6,9,18H,7-8H2,1-3H3
Canonical SMILES:  COCCc1ncc(c2c1[nH]c1c2cccc1OC)OC
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
NPO25272 Celastrus angulatus Species Celastraceae Eukaryota TCM_Taiwan*
NPO8372 Picrasma quassioides Species Simaroubaceae Eukaryota TCM_Taiwan*
NPO15413 Glycyrrhiza pallidiflora Species Fabaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT178 Individual Protein Protein-tyrosine phosphatase 1B Homo sapiens Inhibition = 28.6 % 25819098

  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 NPC26679 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
0.984 High Similarity NPC185782
0.9536 High Similarity NPC8022
0.9536 High Similarity NPC470799
0.9368 High Similarity NPC476138
0.9368 High Similarity NPC245816
0.9171 High Similarity NPC469554
0.911 High Similarity NPC19872
0.9078 High Similarity NPC101543
0.8945 High Similarity NPC476287
0.8814 High Similarity NPC176538
0.8756 High Similarity NPC267928
0.8692 High Similarity NPC148889
0.8673 High Similarity NPC232727
0.8634 High Similarity NPC292958
0.8571 High Similarity NPC476167
0.852 High Similarity NPC192315
0.85 High Similarity NPC26543
0.8483 Intermediate Similarity NPC314954
0.8462 Intermediate Similarity NPC310118
0.8424 Intermediate Similarity NPC123976
0.8424 Intermediate Similarity NPC167860
0.8377 Intermediate Similarity NPC284678
0.8349 Intermediate Similarity NPC110151
0.8333 Intermediate Similarity NPC5145
0.8325 Intermediate Similarity NPC287208
0.8311 Intermediate Similarity NPC53534
0.8308 Intermediate Similarity NPC475774
0.8278 Intermediate Similarity NPC213530
0.8278 Intermediate Similarity NPC193267
0.8272 Intermediate Similarity NPC474798
0.8267 Intermediate Similarity NPC285558
0.8256 Intermediate Similarity NPC76748
0.8223 Intermediate Similarity NPC307963
0.8214 Intermediate Similarity NPC92111
0.8205 Intermediate Similarity NPC296527
0.8177 Intermediate Similarity NPC470500
0.8174 Intermediate Similarity NPC152620
0.8164 Intermediate Similarity NPC94157
0.8141 Intermediate Similarity NPC251090
0.8131 Intermediate Similarity NPC84853
0.8116 Intermediate Similarity NPC208284
0.8113 Intermediate Similarity NPC60621
0.8112 Intermediate Similarity NPC242928
0.8069 Intermediate Similarity NPC315957
0.8065 Intermediate Similarity NPC260434
0.8058 Intermediate Similarity NPC82548
0.8039 Intermediate Similarity NPC223427
0.8 Intermediate Similarity NPC475070
0.7981 Intermediate Similarity NPC132642
0.798 Intermediate Similarity NPC121772
0.796 Intermediate Similarity NPC13880
0.7955 Intermediate Similarity NPC182222
0.7953 Intermediate Similarity NPC122436
0.795 Intermediate Similarity NPC475190
0.7933 Intermediate Similarity NPC174672
0.7933 Intermediate Similarity NPC174758
0.7931 Intermediate Similarity NPC187558
0.7931 Intermediate Similarity NPC128823
0.7913 Intermediate Similarity NPC470930
0.7895 Intermediate Similarity NPC11464
0.7877 Intermediate Similarity NPC170114
0.7877 Intermediate Similarity NPC288349
0.7857 Intermediate Similarity NPC48938
0.7857 Intermediate Similarity NPC176127
0.7844 Intermediate Similarity NPC473185
0.7843 Intermediate Similarity NPC18487
0.7838 Intermediate Similarity NPC295228
0.783 Intermediate Similarity NPC470549
0.7826 Intermediate Similarity NPC329708
0.7826 Intermediate Similarity NPC274291
0.7826 Intermediate Similarity NPC47059
0.7826 Intermediate Similarity NPC264166
0.7826 Intermediate Similarity NPC118832
0.7826 Intermediate Similarity NPC165349
0.781 Intermediate Similarity NPC199667
0.7804 Intermediate Similarity NPC469594
0.7783 Intermediate Similarity NPC162530
0.7783 Intermediate Similarity NPC266931
0.7783 Intermediate Similarity NPC469592
0.7783 Intermediate Similarity NPC471080
0.7772 Intermediate Similarity NPC226202
0.7772 Intermediate Similarity NPC198673
0.7763 Intermediate Similarity NPC471891
0.7762 Intermediate Similarity NPC473181
0.7748 Intermediate Similarity NPC180504
0.7738 Intermediate Similarity NPC476451
0.7738 Intermediate Similarity NPC475253
0.7737 Intermediate Similarity NPC118511
0.7736 Intermediate Similarity NPC473180
0.7736 Intermediate Similarity NPC316981
0.7727 Intermediate Similarity NPC84478
0.7725 Intermediate Similarity NPC258048
0.7723 Intermediate Similarity NPC324149
0.7718 Intermediate Similarity NPC329793
0.7716 Intermediate Similarity NPC161887
0.7714 Intermediate Similarity NPC476465
0.771 Intermediate Similarity NPC274982
0.7707 Intermediate Similarity NPC168911
0.7703 Intermediate Similarity NPC472111
0.7689 Intermediate Similarity NPC101350
0.7689 Intermediate Similarity NPC30540
0.7688 Intermediate Similarity NPC20249
0.7685 Intermediate Similarity NPC473179
0.7668 Intermediate Similarity NPC141053
0.7644 Intermediate Similarity NPC235685
0.7635 Intermediate Similarity NPC99666
0.7633 Intermediate Similarity NPC329747
0.7629 Intermediate Similarity NPC252590
0.7626 Intermediate Similarity NPC219963
0.7623 Intermediate Similarity NPC473186
0.7621 Intermediate Similarity NPC239954
0.7602 Intermediate Similarity NPC224764
0.76 Intermediate Similarity NPC42591
0.76 Intermediate Similarity NPC314002
0.7598 Intermediate Similarity NPC472434
0.7594 Intermediate Similarity NPC209769
0.7593 Intermediate Similarity NPC304926
0.7593 Intermediate Similarity NPC476041
0.758 Intermediate Similarity NPC470501
0.7577 Intermediate Similarity NPC476518
0.757 Intermediate Similarity NPC118940
0.7566 Intermediate Similarity NPC473183
0.7562 Intermediate Similarity NPC171171
0.7561 Intermediate Similarity NPC131017
0.7559 Intermediate Similarity NPC123839
0.7556 Intermediate Similarity NPC39370
0.755 Intermediate Similarity NPC204717
0.7549 Intermediate Similarity NPC195268
0.7549 Intermediate Similarity NPC133140
0.7548 Intermediate Similarity NPC234197
0.7547 Intermediate Similarity NPC266249
0.7547 Intermediate Similarity NPC475910
0.7544 Intermediate Similarity NPC81175
0.7538 Intermediate Similarity NPC266551
0.7538 Intermediate Similarity NPC121658
0.7538 Intermediate Similarity NPC14651
0.7534 Intermediate Similarity NPC470502
0.7525 Intermediate Similarity NPC46580
0.7525 Intermediate Similarity NPC42979
0.7523 Intermediate Similarity NPC187501
0.7512 Intermediate Similarity NPC469589
0.7512 Intermediate Similarity NPC31930
0.75 Intermediate Similarity NPC287437
0.75 Intermediate Similarity NPC220765
0.7488 Intermediate Similarity NPC476581
0.7488 Intermediate Similarity NPC16452
0.7488 Intermediate Similarity NPC36229
0.7478 Intermediate Similarity NPC473184
0.7477 Intermediate Similarity NPC471304
0.7477 Intermediate Similarity NPC219664
0.7476 Intermediate Similarity NPC66815
0.7466 Intermediate Similarity NPC470503
0.7465 Intermediate Similarity NPC148183
0.7465 Intermediate Similarity NPC152768
0.7465 Intermediate Similarity NPC477111
0.7464 Intermediate Similarity NPC249040
0.745 Intermediate Similarity NPC118776
0.745 Intermediate Similarity NPC314394
0.7444 Intermediate Similarity NPC6215
0.7443 Intermediate Similarity NPC17565
0.7443 Intermediate Similarity NPC208084
0.7443 Intermediate Similarity NPC288987
0.7441 Intermediate Similarity NPC162484
0.7435 Intermediate Similarity NPC473312
0.7432 Intermediate Similarity NPC21638
0.7427 Intermediate Similarity NPC106937
0.7425 Intermediate Similarity NPC91868
0.7425 Intermediate Similarity NPC63971
0.7424 Intermediate Similarity NPC477861
0.7416 Intermediate Similarity NPC476582
0.7416 Intermediate Similarity NPC4071
0.7416 Intermediate Similarity NPC476578
0.7415 Intermediate Similarity NPC472435
0.7411 Intermediate Similarity NPC111624
0.7409 Intermediate Similarity NPC225279
0.7409 Intermediate Similarity NPC177404
0.7407 Intermediate Similarity NPC296482
0.7407 Intermediate Similarity NPC203168
0.7407 Intermediate Similarity NPC202768
0.7407 Intermediate Similarity NPC53069
0.7404 Intermediate Similarity NPC70956
0.7404 Intermediate Similarity NPC243834
0.7404 Intermediate Similarity NPC77555
0.7398 Intermediate Similarity NPC314940
0.7398 Intermediate Similarity NPC473764
0.7393 Intermediate Similarity NPC211813
0.7393 Intermediate Similarity NPC473761
0.7391 Intermediate Similarity NPC99891
0.7389 Intermediate Similarity NPC49547
0.7389 Intermediate Similarity NPC196718
0.7387 Intermediate Similarity NPC65277
0.7385 Intermediate Similarity NPC477110
0.7381 Intermediate Similarity NPC477019
0.738 Intermediate Similarity NPC11408
0.7373 Intermediate Similarity NPC221100
0.7373 Intermediate Similarity NPC39500
0.7373 Intermediate Similarity NPC234078
0.7373 Intermediate Similarity NPC478074
0.7371 Intermediate Similarity NPC323345
0.7371 Intermediate Similarity NPC470164

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC26679 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
0.8223 Intermediate Similarity NPD1304 Clinical (unspecified phase)
0.8223 Intermediate Similarity NPD1038 Approved
0.8177 Intermediate Similarity NPD4795 Phase 2
0.8165 Intermediate Similarity NPD3006 Discontinued
0.8136 Intermediate Similarity NPD2921 Clinical (unspecified phase)
0.8089 Intermediate Similarity NPD5482 Discontinued
0.8072 Intermediate Similarity NPD5483 Clinical (unspecified phase)
0.8069 Intermediate Similarity NPD1740 Approved
0.8069 Intermediate Similarity NPD1739 Approved
0.802 Intermediate Similarity NPD3825 Phase 3
0.7991 Intermediate Similarity NPD1856 Discontinued
0.7971 Intermediate Similarity NPD5658 Approved
0.789 Intermediate Similarity NPD5559 Phase 2
0.7877 Intermediate Similarity NPD5612 Discontinued
0.784 Intermediate Similarity NPD7823 Clinical (unspecified phase)
0.7837 Intermediate Similarity NPD1392 Approved
0.7828 Intermediate Similarity NPD7558 Phase 2
0.7828 Intermediate Similarity NPD5256 Discontinued
0.7826 Intermediate Similarity NPD31 Approved
0.7826 Intermediate Similarity NPD4033 Approved
0.7826 Intermediate Similarity NPD4037 Approved
0.7826 Intermediate Similarity NPD4039 Approved
0.7826 Intermediate Similarity NPD32 Approved
0.7826 Intermediate Similarity NPD4035 Approved
0.7826 Intermediate Similarity NPD4122 Approved
0.7826 Intermediate Similarity NPD4038 Approved
0.7826 Intermediate Similarity NPD4034 Approved
0.7826 Intermediate Similarity NPD4036 Approved
0.7822 Intermediate Similarity NPD3324 Clinical (unspecified phase)
0.7793 Intermediate Similarity NPD6643 Discontinued
0.7773 Intermediate Similarity NPD5066 Phase 2
0.7773 Intermediate Similarity NPD4502 Phase 2
0.7773 Intermediate Similarity NPD5067 Phase 2
0.7756 Intermediate Similarity NPD4118 Clinical (unspecified phase)
0.7721 Intermediate Similarity NPD4429 Discontinued
0.7714 Intermediate Similarity NPD2187 Approved
0.7714 Intermediate Similarity NPD2189 Approved
0.7709 Intermediate Similarity NPD4440 Clinical (unspecified phase)
0.7703 Intermediate Similarity NPD3003 Approved
0.7696 Intermediate Similarity NPD3477 Phase 2
0.7696 Intermediate Similarity NPD3478 Clinical (unspecified phase)
0.7689 Intermediate Similarity NPD3939 Suspended
0.7685 Intermediate Similarity NPD3514 Clinical (unspecified phase)
0.7682 Intermediate Similarity NPD6961 Discontinued
0.7679 Intermediate Similarity NPD4454 Phase 2
0.7679 Intermediate Similarity NPD5450 Discontinued
0.767 Intermediate Similarity NPD4548 Discontinued
0.7664 Intermediate Similarity NPD6140 Clinical (unspecified phase)
0.7636 Intermediate Similarity NPD7603 Discontinued
0.7632 Intermediate Similarity NPD9705 Discontinued
0.7632 Intermediate Similarity NPD112 Approved
0.7605 Intermediate Similarity NPD3343 Phase 3
0.7604 Intermediate Similarity NPD3402 Phase 1
0.7583 Intermediate Similarity NPD7222 Phase 2
0.7569 Intermediate Similarity NPD6242 Discontinued
0.7566 Intermediate Similarity NPD4958 Clinical (unspecified phase)
0.7555 Intermediate Similarity NPD7067 Approved
0.7555 Intermediate Similarity NPD7068 Approved
0.7549 Intermediate Similarity NPD3924 Approved
0.7549 Intermediate Similarity NPD3922 Approved
0.7549 Intermediate Similarity NPD4372 Phase 1
0.7549 Intermediate Similarity NPD3921 Approved
0.7549 Intermediate Similarity NPD6569 Phase 2
0.7549 Intermediate Similarity NPD3923 Approved
0.7525 Intermediate Similarity NPD1034 Phase 3
0.7525 Intermediate Similarity NPD1033 Clinical (unspecified phase)
0.7523 Intermediate Similarity NPD4131 Phase 3
0.7512 Intermediate Similarity NPD5575 Clinical (unspecified phase)
0.7511 Intermediate Similarity NPD6494 Phase 2
0.75 Intermediate Similarity NPD2177 Approved
0.75 Intermediate Similarity NPD2175 Phase 3
0.75 Intermediate Similarity NPD5902 Approved
0.75 Intermediate Similarity NPD2176 Approved
0.75 Intermediate Similarity NPD5903 Approved
0.75 Intermediate Similarity NPD5999 Phase 2
0.75 Intermediate Similarity NPD1768 Approved
0.7489 Intermediate Similarity NPD5930 Phase 3
0.7455 Intermediate Similarity NPD5022 Discontinued
0.7455 Intermediate Similarity NPD4881 Clinical (unspecified phase)
0.7454 Intermediate Similarity NPD1322 Clinical (unspecified phase)
0.745 Intermediate Similarity NPD4204 Approved
0.745 Intermediate Similarity NPD4203 Approved
0.7444 Intermediate Similarity NPD6553 Clinical (unspecified phase)
0.7443 Intermediate Similarity NPD7194 Discontinued
0.7427 Intermediate Similarity NPD802 Phase 2
0.7418 Intermediate Similarity NPD7452 Approved
0.7418 Intermediate Similarity NPD7453 Approved
0.7418 Intermediate Similarity NPD5018 Phase 3
0.7407 Intermediate Similarity NPD3330 Phase 1
0.7407 Intermediate Similarity NPD3815 Phase 1
0.7407 Intermediate Similarity NPD3816 Phase 1
0.7398 Intermediate Similarity NPD565 Phase 2
0.7383 Intermediate Similarity NPD5863 Clinical (unspecified phase)
0.7378 Intermediate Similarity NPD8512 Phase 3
0.7376 Intermediate Similarity NPD5083 Clinical (unspecified phase)
0.7371 Intermediate Similarity NPD5530 Phase 1
0.7361 Intermediate Similarity NPD949 Phase 1
0.7357 Intermediate Similarity NPD6741 Clinical (unspecified phase)
0.7352 Intermediate Similarity NPD5164 Discontinued
0.7349 Intermediate Similarity NPD4437 Phase 3
0.7349 Intermediate Similarity NPD2125 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD8442 Discontinued
0.7342 Intermediate Similarity NPD6160 Clinical (unspecified phase)
0.7327 Intermediate Similarity NPD6202 Discontinued
0.7321 Intermediate Similarity NPD7948 Phase 1
0.7321 Intermediate Similarity NPD1273 Discontinued
0.7309 Intermediate Similarity NPD6306 Phase 2
0.7308 Intermediate Similarity NPD6861 Clinical (unspecified phase)
0.7308 Intermediate Similarity NPD4418 Discontinued
0.7304 Intermediate Similarity NPD4920 Clinical (unspecified phase)
0.7304 Intermediate Similarity NPD4921 Phase 3
0.7304 Intermediate Similarity NPD4919 Phase 3
0.7281 Intermediate Similarity NPD5936 Approved
0.7281 Intermediate Similarity NPD5939 Approved
0.7281 Intermediate Similarity NPD6223 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD4558 Phase 2
0.7277 Intermediate Similarity NPD3386 Phase 2
0.7259 Intermediate Similarity NPD6872 Clinical (unspecified phase)
0.7256 Intermediate Similarity NPD6290 Phase 2
0.7254 Intermediate Similarity NPD2581 Approved
0.7254 Intermediate Similarity NPD2582 Approved
0.7252 Intermediate Similarity NPD6856 Discontinued
0.7246 Intermediate Similarity NPD5912 Clinical (unspecified phase)
0.7246 Intermediate Similarity NPD5913 Phase 3
0.7243 Intermediate Similarity NPD3397 Phase 2
0.724 Intermediate Similarity NPD6985 Discontinued
0.724 Intermediate Similarity NPD5632 Approved
0.7225 Intermediate Similarity NPD6969 Phase 2
0.7225 Intermediate Similarity NPD6968 Phase 2
0.7213 Intermediate Similarity NPD4442 Phase 2
0.721 Intermediate Similarity NPD6473 Phase 1
0.7209 Intermediate Similarity NPD3842 Clinical (unspecified phase)
0.7209 Intermediate Similarity NPD5601 Phase 2
0.7209 Intermediate Similarity NPD8403 Phase 1
0.7207 Intermediate Similarity NPD3763 Approved
0.7205 Intermediate Similarity NPD2471 Approved
0.7205 Intermediate Similarity NPD2472 Approved
0.7203 Intermediate Similarity NPD5644 Phase 1
0.7202 Intermediate Similarity NPD3570 Phase 2
0.7202 Intermediate Similarity NPD6220 Phase 3
0.72 Intermediate Similarity NPD9690 Approved
0.72 Intermediate Similarity NPD1258 Discontinued
0.7198 Intermediate Similarity NPD4858 Phase 2
0.7196 Intermediate Similarity NPD2121 Clinical (unspecified phase)
0.7192 Intermediate Similarity NPD7414 Clinical (unspecified phase)
0.719 Intermediate Similarity NPD6550 Discontinued
0.7186 Intermediate Similarity NPD4343 Phase 1
0.7186 Intermediate Similarity NPD4344 Clinical (unspecified phase)
0.7186 Intermediate Similarity NPD1078 Clinical (unspecified phase)
0.7184 Intermediate Similarity NPD6257 Clinical (unspecified phase)
0.7179 Intermediate Similarity NPD1418 Phase 2
0.7174 Intermediate Similarity NPD6963 Approved
0.7174 Intermediate Similarity NPD6964 Approved
0.7173 Intermediate Similarity NPD6243 Phase 3
0.7173 Intermediate Similarity NPD6244 Phase 3
0.7171 Intermediate Similarity NPD4889 Approved
0.7156 Intermediate Similarity NPD1229 Phase 2
0.7149 Intermediate Similarity NPD6147 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD5528 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD5529 Phase 1
0.7136 Intermediate Similarity NPD5944 Phase 1
0.7136 Intermediate Similarity NPD5945 Phase 1
0.7136 Intermediate Similarity NPD484 Approved
0.713 Intermediate Similarity NPD3875 Discontinued
0.7129 Intermediate Similarity NPD4072 Approved
0.7129 Intermediate Similarity NPD4071 Approved
0.7119 Intermediate Similarity NPD8100 Phase 3
0.7117 Intermediate Similarity NPD3440 Clinical (unspecified phase)
0.7114 Intermediate Similarity NPD5065 Approved
0.7111 Intermediate Similarity NPD6824 Clinical (unspecified phase)
0.71 Intermediate Similarity NPD2951 Discontinued
0.7095 Intermediate Similarity NPD4551 Phase 2
0.7095 Intermediate Similarity NPD5911 Clinical (unspecified phase)
0.7094 Intermediate Similarity NPD1620 Clinical (unspecified phase)
0.7094 Intermediate Similarity NPD3920 Phase 2
0.7093 Intermediate Similarity NPD7426 Phase 1
0.7093 Intermediate Similarity NPD7050 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD7675 Phase 3
0.7093 Intermediate Similarity NPD7676 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD7051 Phase 3
0.7093 Intermediate Similarity NPD7674 Phase 3
0.7091 Intermediate Similarity NPD7069 Discontinued
0.7087 Intermediate Similarity NPD4885 Approved
0.7085 Intermediate Similarity NPD8109 Clinical (unspecified phase)
0.7085 Intermediate Similarity NPD3354 Phase 2
0.7085 Intermediate Similarity NPD6568 Discontinued
0.7082 Intermediate Similarity NPD7729 Clinical (unspecified phase)
0.7075 Intermediate Similarity NPD2952 Discontinued
0.7075 Intermediate Similarity NPD6769 Clinical (unspecified phase)
0.7074 Intermediate Similarity NPD5479 Discontinued
0.7072 Intermediate Similarity NPD6803 Clinical (unspecified phase)
0.7071 Intermediate Similarity NPD6503 Clinical (unspecified phase)
0.7062 Intermediate Similarity NPD3396 Approved
0.7062 Intermediate Similarity NPD6590 Discontinued
0.7062 Intermediate Similarity NPD3395 Approved
0.7053 Intermediate Similarity NPD4375 Approved
0.7051 Intermediate Similarity NPD4862 Clinical (unspecified phase)
0.7048 Intermediate Similarity NPD4890 Phase 2
0.7048 Intermediate Similarity NPD3938 Phase 1
0.7044 Intermediate Similarity NPD1032 Phase 2

Structure

External Identifiers

PubChem CID   5316865
ChEMBL   CHEMBL3400672
ZINC  

Physicochemical Properties

Molecular Weight:  286.13
ALogP:  -0.8522
MLogP:  2.67
XLogP:  1.614
# Rotatable Bonds:  8
Polar Surface Area:  56.37
# H-Bond Aceptor:  3
# H-Bond Donor:  1
# Rings:  3
# Heavy Atoms:  21

Download Data

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Biological Activities  
Similar NPs/Drugs