Natural Product: NPC280548

Natural Product ID:  NPC280548
Common Name:   Variecolorin L
IUPAC Name:   (3S,6S)-3-methyl-6-[[2-(2-methylbut-3-en-2-yl)-4,5-bis(3-methylbut-2-enyl)-1H-indol-3-yl]methyl]piperazine-2,5-dione
Synonyms:   Variecolorin L
Molecular Formula:   C29H39N3O2
Standard InCHIKey:  XYEWKBJTXXXGRB-CYFREDJKSA-N
Standard InCHI:  InChI=1S/C29H39N3O2/c1-9-29(7,8)26-22(16-24-28(34)30-19(6)27(33)32-24)25-21(14-11-18(4)5)20(12-10-17(2)3)13-15-23(25)31-26/h9-11,13,15,19,24,31H,1,12,14,16H2,2-8H3,(H,30,34)(H,32,33)/t19-,24-/m0/s1
Canonical SMILES:  C=CC(c1[nH]c2c(c1C[C@@H]1N=C(O)[C@@H](N=C1O)C)c(CC=C(C)C)c(cc2)CC=C(C)C)(C)C
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
NPO31540 Aspergillus variecolor Species Aspergillaceae Eukaryota PMID[17896816]
NPO32640 eurotium rubrum ma-150 Species Aspergillaceae Eukaryota Fungus Obtained from Marine Mangrove-Derived Rhizospheric Soil. PMID[25730346]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified IC50 = 623000 nM PubChem BioAssay data set
NPT2 Others Unspecified IC50 > 50000 nM 19928902
NPT181 Cell Line Bel-7402 Homo sapiens IC50 > 50000 nM 19223619
NPT116 Cell Line HL-60 Homo sapiens IC50 > 50000 nM PubChem BioAssay data set
NPT168 Cell Line P388 Mus musculus IC50 > 50000 nM 19029328

  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 NPC280548 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
0.9673 High Similarity NPC16667
0.9542 High Similarity NPC67056
0.9412 High Similarity NPC285469
0.9346 High Similarity NPC207726
0.9299 High Similarity NPC470508
0.9038 High Similarity NPC184476
0.8994 High Similarity NPC472587
0.8974 High Similarity NPC38736
0.8896 High Similarity NPC34508
0.8727 High Similarity NPC472586
0.8718 High Similarity NPC187951
0.8718 High Similarity NPC124005
0.8718 High Similarity NPC37548
0.8683 High Similarity NPC270009
0.8675 High Similarity NPC288785
0.865 High Similarity NPC49954
0.865 High Similarity NPC474561
0.8642 High Similarity NPC194640
0.8639 High Similarity NPC19679
0.859 High Similarity NPC129042
0.858 High Similarity NPC192270
0.858 High Similarity NPC282231
0.8571 High Similarity NPC472443
0.8529 High Similarity NPC472444
0.8519 High Similarity NPC279918
0.85 High Similarity NPC470507
0.8485 Intermediate Similarity NPC63751
0.8462 Intermediate Similarity NPC242556
0.8424 Intermediate Similarity NPC160105
0.8405 Intermediate Similarity NPC473320
0.8391 Intermediate Similarity NPC46413
0.8383 Intermediate Similarity NPC6982
0.838 Intermediate Similarity NPC32200
0.8333 Intermediate Similarity NPC141353
0.8313 Intermediate Similarity NPC54988
0.8294 Intermediate Similarity NPC293472
0.8268 Intermediate Similarity NPC229332
0.8263 Intermediate Similarity NPC201700
0.8229 Intermediate Similarity NPC317030
0.8225 Intermediate Similarity NPC314603
0.8214 Intermediate Similarity NPC194411
0.821 Intermediate Similarity NPC25008
0.821 Intermediate Similarity NPC469765
0.821 Intermediate Similarity NPC259644
0.821 Intermediate Similarity NPC469760
0.821 Intermediate Similarity NPC469763
0.821 Intermediate Similarity NPC469786
0.821 Intermediate Similarity NPC73952
0.8199 Intermediate Similarity NPC33421
0.8193 Intermediate Similarity NPC271734
0.8187 Intermediate Similarity NPC68354
0.8187 Intermediate Similarity NPC248454
0.8187 Intermediate Similarity NPC59269
0.8182 Intermediate Similarity NPC173028
0.8182 Intermediate Similarity NPC65215
0.8176 Intermediate Similarity NPC189812
0.8176 Intermediate Similarity NPC329688
0.816 Intermediate Similarity NPC75540
0.816 Intermediate Similarity NPC212376
0.816 Intermediate Similarity NPC471458
0.816 Intermediate Similarity NPC211572
0.816 Intermediate Similarity NPC80597
0.816 Intermediate Similarity NPC70922
0.8136 Intermediate Similarity NPC95783
0.8125 Intermediate Similarity NPC204565
0.8118 Intermediate Similarity NPC472123
0.807 Intermediate Similarity NPC275305
0.807 Intermediate Similarity NPC37423
0.8068 Intermediate Similarity NPC474707
0.8066 Intermediate Similarity NPC232130
0.8061 Intermediate Similarity NPC469762
0.8047 Intermediate Similarity NPC154293
0.8047 Intermediate Similarity NPC317430
0.8039 Intermediate Similarity NPC22079
0.8 Intermediate Similarity NPC469785
0.8 Intermediate Similarity NPC163055
0.8 Intermediate Similarity NPC474177
0.7978 Intermediate Similarity NPC246700
0.7976 Intermediate Similarity NPC311276
0.7963 Intermediate Similarity NPC477134
0.7956 Intermediate Similarity NPC133366
0.7955 Intermediate Similarity NPC165495
0.7952 Intermediate Similarity NPC299594
0.7931 Intermediate Similarity NPC215795
0.7931 Intermediate Similarity NPC213468
0.7931 Intermediate Similarity NPC219336
0.7931 Intermediate Similarity NPC176199
0.791 Intermediate Similarity NPC476319
0.7907 Intermediate Similarity NPC97525
0.7904 Intermediate Similarity NPC206819
0.7904 Intermediate Similarity NPC318065
0.7898 Intermediate Similarity NPC139291
0.7898 Intermediate Similarity NPC472108
0.7886 Intermediate Similarity NPC91179
0.7886 Intermediate Similarity NPC300688
0.7874 Intermediate Similarity NPC151939
0.7874 Intermediate Similarity NPC15573
0.7874 Intermediate Similarity NPC217372
0.7874 Intermediate Similarity NPC183662
0.7871 Intermediate Similarity NPC475450
0.7871 Intermediate Similarity NPC179365
0.7857 Intermediate Similarity NPC195314
0.7841 Intermediate Similarity NPC233936
0.784 Intermediate Similarity NPC314372
0.7833 Intermediate Similarity NPC106833
0.7833 Intermediate Similarity NPC469497
0.7829 Intermediate Similarity NPC72980
0.7816 Intermediate Similarity NPC267885
0.7812 Intermediate Similarity NPC2949
0.7809 Intermediate Similarity NPC15102
0.7798 Intermediate Similarity NPC41257
0.7798 Intermediate Similarity NPC230869
0.7784 Intermediate Similarity NPC198339
0.7778 Intermediate Similarity NPC128751
0.7772 Intermediate Similarity NPC153042
0.7765 Intermediate Similarity NPC40779
0.776 Intermediate Similarity NPC181502
0.776 Intermediate Similarity NPC85066
0.7759 Intermediate Similarity NPC110500
0.7759 Intermediate Similarity NPC203468
0.7759 Intermediate Similarity NPC149155
0.7758 Intermediate Similarity NPC105818
0.7758 Intermediate Similarity NPC24678
0.7753 Intermediate Similarity NPC190007
0.7753 Intermediate Similarity NPC472294
0.775 Intermediate Similarity NPC312092
0.7749 Intermediate Similarity NPC475422
0.7742 Intermediate Similarity NPC473587
0.7738 Intermediate Similarity NPC129721
0.7738 Intermediate Similarity NPC286427
0.7737 Intermediate Similarity NPC87755
0.7735 Intermediate Similarity NPC314333
0.7727 Intermediate Similarity NPC88363
0.7727 Intermediate Similarity NPC126709
0.7727 Intermediate Similarity NPC248041
0.7717 Intermediate Similarity NPC205403
0.7716 Intermediate Similarity NPC190296
0.7709 Intermediate Similarity NPC94943
0.7692 Intermediate Similarity NPC475428
0.7692 Intermediate Similarity NPC56765
0.7684 Intermediate Similarity NPC469896
0.768 Intermediate Similarity NPC213629
0.7677 Intermediate Similarity NPC473762
0.7674 Intermediate Similarity NPC109447
0.7673 Intermediate Similarity NPC325252
0.7667 Intermediate Similarity NPC235684
0.7661 Intermediate Similarity NPC90723
0.7654 Intermediate Similarity NPC63157
0.7654 Intermediate Similarity NPC473868
0.7654 Intermediate Similarity NPC165201
0.765 Intermediate Similarity NPC477167
0.765 Intermediate Similarity NPC473342
0.7647 Intermediate Similarity NPC44773
0.7647 Intermediate Similarity NPC215584
0.7644 Intermediate Similarity NPC158129
0.764 Intermediate Similarity NPC302191
0.7637 Intermediate Similarity NPC469470
0.7637 Intermediate Similarity NPC469501
0.7637 Intermediate Similarity NPC329858
0.7636 Intermediate Similarity NPC21605
0.7634 Intermediate Similarity NPC473747
0.763 Intermediate Similarity NPC78020
0.7627 Intermediate Similarity NPC283219
0.7627 Intermediate Similarity NPC133261
0.7622 Intermediate Similarity NPC11445
0.7611 Intermediate Similarity NPC473189
0.761 Intermediate Similarity NPC198988
0.7598 Intermediate Similarity NPC472110
0.7598 Intermediate Similarity NPC472109
0.7598 Intermediate Similarity NPC212535
0.7596 Intermediate Similarity NPC243716
0.7595 Intermediate Similarity NPC473930
0.7593 Intermediate Similarity NPC469780
0.7593 Intermediate Similarity NPC469768
0.7593 Intermediate Similarity NPC469779
0.7593 Intermediate Similarity NPC59084
0.7593 Intermediate Similarity NPC469767
0.7593 Intermediate Similarity NPC469783
0.7593 Intermediate Similarity NPC469761
0.7593 Intermediate Similarity NPC469784
0.7582 Intermediate Similarity NPC175474
0.7582 Intermediate Similarity NPC34271
0.7582 Intermediate Similarity NPC321708
0.7571 Intermediate Similarity NPC326575
0.7571 Intermediate Similarity NPC14113
0.7571 Intermediate Similarity NPC84827
0.7571 Intermediate Similarity NPC145885
0.7569 Intermediate Similarity NPC94752
0.7568 Intermediate Similarity NPC195239
0.7568 Intermediate Similarity NPC157828
0.7562 Intermediate Similarity NPC218268
0.7556 Intermediate Similarity NPC228835
0.7553 Intermediate Similarity NPC475151
0.7552 Intermediate Similarity NPC314957
0.7548 Intermediate Similarity NPC250361
0.7546 Intermediate Similarity NPC469766
0.7544 Intermediate Similarity NPC81229
0.7544 Intermediate Similarity NPC131718
0.7544 Intermediate Similarity NPC255229
0.754 Intermediate Similarity NPC52557

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC280548 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
0.8683 High Similarity NPD8386 Phase 2
0.8659 High Similarity NPD1325 Approved
0.8659 High Similarity NPD1326 Approved
0.8589 High Similarity NPD5744 Clinical (unspecified phase)
0.8246 Intermediate Similarity NPD4076 Approved
0.8246 Intermediate Similarity NPD4079 Approved
0.8229 Intermediate Similarity NPD8431 Approved
0.8214 Intermediate Similarity NPD4184 Clinical (unspecified phase)
0.8198 Intermediate Similarity NPD8464 Clinical (unspecified phase)
0.8187 Intermediate Similarity NPD3506 Approved
0.8187 Intermediate Similarity NPD3505 Approved
0.8114 Intermediate Similarity NPD6610 Clinical (unspecified phase)
0.8113 Intermediate Similarity NPD5254 Discontinued
0.8047 Intermediate Similarity NPD5021 Discontinued
0.8023 Intermediate Similarity NPD6375 Clinical (unspecified phase)
0.8012 Intermediate Similarity NPD4112 Clinical (unspecified phase)
0.7989 Intermediate Similarity NPD6595 Phase 3
0.7989 Intermediate Similarity NPD6630 Clinical (unspecified phase)
0.7977 Intermediate Similarity NPD6203 Clinical (unspecified phase)
0.7977 Intermediate Similarity NPD2144 Approved
0.7914 Intermediate Similarity NPD3100 Discontinued
0.7866 Intermediate Similarity NPD4462 Approved
0.7866 Intermediate Similarity NPD4463 Approved
0.7861 Intermediate Similarity NPD4128 Approved
0.7841 Intermediate Similarity NPD3038 Discontinued
0.7836 Intermediate Similarity NPD4639 Approved
0.7836 Intermediate Similarity NPD4640 Approved
0.7836 Intermediate Similarity NPD4638 Approved
0.7812 Intermediate Similarity NPD3943 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD8110 Clinical (unspecified phase)
0.7759 Intermediate Similarity NPD482 Approved
0.7758 Intermediate Similarity NPD2172 Phase 1
0.7735 Intermediate Similarity NPD4499 Approved
0.7722 Intermediate Similarity NPD3961 Discontinued
0.7714 Intermediate Similarity NPD749 Clinical (unspecified phase)
0.7714 Intermediate Similarity NPD4075 Phase 2
0.7701 Intermediate Similarity NPD4511 Phase 1
0.7697 Intermediate Similarity NPD2092 Phase 2
0.7697 Intermediate Similarity NPD2094 Phase 2
0.7697 Intermediate Similarity NPD5728 Clinical (unspecified phase)
0.7697 Intermediate Similarity NPD2095 Phase 2
0.7654 Intermediate Similarity NPD2096 Phase 2
0.7654 Intermediate Similarity NPD2091 Phase 2
0.7654 Intermediate Similarity NPD1592 Phase 3
0.7602 Intermediate Similarity NPD972 Clinical (unspecified phase)
0.7576 Intermediate Similarity NPD1683 Approved
0.7571 Intermediate Similarity NPD4181 Approved
0.7558 Intermediate Similarity NPD3323 Discontinued
0.7557 Intermediate Similarity NPD5065 Approved
0.7531 Intermediate Similarity NPD786 Approved
0.7529 Intermediate Similarity NPD2844 Phase 3
0.7527 Intermediate Similarity NPD3486 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD750 Phase 2
0.7487 Intermediate Similarity NPD5901 Discontinued
0.746 Intermediate Similarity NPD4601 Approved
0.746 Intermediate Similarity NPD4600 Approved
0.7459 Intermediate Similarity NPD3607 Clinical (unspecified phase)
0.7457 Intermediate Similarity NPD5140 Approved
0.7457 Intermediate Similarity NPD5138 Approved
0.7443 Intermediate Similarity NPD5934 Clinical (unspecified phase)
0.7432 Intermediate Similarity NPD6141 Clinical (unspecified phase)
0.7416 Intermediate Similarity NPD5100 Phase 3
0.7407 Intermediate Similarity NPD1262 Discovery
0.7396 Intermediate Similarity NPD6476 Clinical (unspecified phase)
0.7396 Intermediate Similarity NPD6158 Phase 2
0.7394 Intermediate Similarity NPD7948 Phase 1
0.7381 Intermediate Similarity NPD4374 Clinical (unspecified phase)
0.7346 Intermediate Similarity NPD198 Clinical (unspecified phase)
0.7345 Intermediate Similarity NPD3610 Approved
0.7345 Intermediate Similarity NPD3609 Approved
0.7341 Intermediate Similarity NPD1403 Approved
0.7341 Intermediate Similarity NPD1404 Approved
0.7333 Intermediate Similarity NPD1722 Approved
0.733 Intermediate Similarity NPD4779 Clinical (unspecified phase)
0.733 Intermediate Similarity NPD2641 Approved
0.733 Intermediate Similarity NPD2640 Approved
0.733 Intermediate Similarity NPD2185 Clinical (unspecified phase)
0.733 Intermediate Similarity NPD5069 Clinical (unspecified phase)
0.7326 Intermediate Similarity NPD5575 Clinical (unspecified phase)
0.7321 Intermediate Similarity NPD4702 Approved
0.7321 Intermediate Similarity NPD4703 Approved
0.7318 Intermediate Similarity NPD2380 Approved
0.7318 Intermediate Similarity NPD2381 Approved
0.7318 Intermediate Similarity NPD2382 Approved
0.7316 Intermediate Similarity NPD7621 Clinical (unspecified phase)
0.7314 Intermediate Similarity NPD4550 Clinical (unspecified phase)
0.7294 Intermediate Similarity NPD2882 Phase 1
0.7292 Intermediate Similarity NPD8073 Approved
0.7289 Intermediate Similarity NPD4637 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD2642 Approved
0.7273 Intermediate Similarity NPD2639 Approved
0.7268 Intermediate Similarity NPD7958 Clinical (unspecified phase)
0.7268 Intermediate Similarity NPD7957 Phase 1
0.7254 Intermediate Similarity NPD8072 Approved
0.7249 Intermediate Similarity NPD6449 Clinical (unspecified phase)
0.7243 Intermediate Similarity NPD2383 Phase 1
0.7219 Intermediate Similarity NPD5912 Clinical (unspecified phase)
0.7219 Intermediate Similarity NPD5913 Phase 3
0.7211 Intermediate Similarity NPD6664 Approved
0.7208 Intermediate Similarity NPD7998 Clinical (unspecified phase)
0.7208 Intermediate Similarity NPD7825 Clinical (unspecified phase)
0.7204 Intermediate Similarity NPD1534 Approved
0.7202 Intermediate Similarity NPD5721 Clinical (unspecified phase)
0.7198 Intermediate Similarity NPD7824 Approved
0.7196 Intermediate Similarity NPD3791 Clinical (unspecified phase)
0.7194 Intermediate Similarity NPD7947 Clinical (unspecified phase)
0.7188 Intermediate Similarity NPD3654 Approved
0.7181 Intermediate Similarity NPD3404 Approved
0.7179 Intermediate Similarity NPD4862 Clinical (unspecified phase)
0.7171 Intermediate Similarity NPD7271 Approved
0.7168 Intermediate Similarity NPD2150 Discontinued
0.7166 Intermediate Similarity NPD2564 Approved
0.7166 Intermediate Similarity NPD2565 Phase 2
0.7165 Intermediate Similarity NPD2920 Discontinued
0.7157 Intermediate Similarity NPD2125 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD8493 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD2177 Approved
0.7135 Intermediate Similarity NPD6344 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD4118 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD3833 Phase 3
0.7135 Intermediate Similarity NPD3835 Phase 3
0.7135 Intermediate Similarity NPD2176 Approved
0.7135 Intermediate Similarity NPD2175 Phase 3
0.7128 Intermediate Similarity NPD5426 Phase 3
0.7128 Intermediate Similarity NPD8272 Phase 2
0.712 Intermediate Similarity NPD5596 Phase 2
0.712 Intermediate Similarity NPD5003 Discontinued
0.7117 Intermediate Similarity NPD3385 Approved
0.7105 Intermediate Similarity NPD7618 Phase 3
0.7105 Intermediate Similarity NPD7619 Phase 3
0.7104 Intermediate Similarity NPD702 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD7731 Approved
0.7101 Intermediate Similarity NPD7730 Approved
0.7086 Intermediate Similarity NPD1554 Clinical (unspecified phase)
0.7074 Intermediate Similarity NPD6281 Approved
0.7072 Intermediate Similarity NPD6492 Phase 2
0.7069 Intermediate Similarity NPD2580 Discontinued
0.7053 Intermediate Similarity NPD1304 Clinical (unspecified phase)
0.7053 Intermediate Similarity NPD1038 Approved
0.7052 Intermediate Similarity NPD2837 Discontinued
0.705 Intermediate Similarity NPD8093 Discontinued
0.7047 Intermediate Similarity NPD3814 Phase 1
0.7047 Intermediate Similarity NPD6661 Clinical (unspecified phase)
0.7039 Intermediate Similarity NPD7717 Approved
0.7039 Intermediate Similarity NPD7716 Approved
0.7029 Intermediate Similarity NPD4669 Clinical (unspecified phase)
0.7029 Intermediate Similarity NPD4671 Clinical (unspecified phase)
0.7029 Intermediate Similarity NPD4326 Phase 2
0.7029 Intermediate Similarity NPD4670 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD3320 Approved
0.7027 Intermediate Similarity NPD5522 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD3318 Approved
0.7027 Intermediate Similarity NPD5106 Approved
0.7027 Intermediate Similarity NPD3319 Phase 1
0.7027 Intermediate Similarity NPD5105 Approved
0.7021 Intermediate Similarity NPD6965 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD4547 Phase 3
0.7016 Intermediate Similarity NPD4602 Approved
0.7015 Intermediate Similarity NPD8488 Clinical (unspecified phase)
0.7011 Intermediate Similarity NPD6452 Discontinued
0.7011 Intermediate Similarity NPD5257 Clinical (unspecified phase)
0.701 Intermediate Similarity NPD4500 Approved
0.701 Intermediate Similarity NPD4501 Approved
0.7006 Intermediate Similarity NPD5315 Discontinued
0.7006 Intermediate Similarity NPD1684 Approved
0.7006 Intermediate Similarity NPD1685 Approved
0.7005 Intermediate Similarity NPD3003 Approved
0.7005 Intermediate Similarity NPD6976 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD7470 Discontinued
0.7 Intermediate Similarity NPD8013 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD5936 Approved
0.7 Intermediate Similarity NPD5939 Approved
0.6995 Remote Similarity NPD7889 Clinical (unspecified phase)
0.6995 Remote Similarity NPD3230 Clinical (unspecified phase)
0.6995 Remote Similarity NPD7865 Approved
0.6982 Remote Similarity NPD3717 Discontinued
0.698 Remote Similarity NPD8112 Clinical (unspecified phase)
0.6973 Remote Similarity NPD4383 Clinical (unspecified phase)
0.697 Remote Similarity NPD8322 Phase 2
0.697 Remote Similarity NPD6838 Clinical (unspecified phase)
0.697 Remote Similarity NPD4880 Discontinued
0.6968 Remote Similarity NPD4948 Discontinued
0.6965 Remote Similarity NPD7454 Approved
0.6965 Remote Similarity NPD8458 Clinical (unspecified phase)
0.6965 Remote Similarity NPD7455 Approved
0.6965 Remote Similarity NPD7594 Clinical (unspecified phase)
0.6963 Remote Similarity NPD802 Phase 2
0.6938 Remote Similarity NPD6978 Phase 2
0.6938 Remote Similarity NPD6977 Clinical (unspecified phase)
0.6934 Remote Similarity NPD7952 Approved
0.6934 Remote Similarity NPD7953 Approved
0.6934 Remote Similarity NPD7950 Approved
0.6934 Remote Similarity NPD7791 Approved
0.6934 Remote Similarity NPD7789 Approved
0.6934 Remote Similarity NPD7951 Approved
0.6934 Remote Similarity NPD7790 Approved
0.6931 Remote Similarity NPD8094 Discontinued
0.6928 Remote Similarity NPD3864 Clinical (unspecified phase)
0.6927 Remote Similarity NPD7944 Discontinued
0.6927 Remote Similarity NPD3810 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   23655532
ChEMBL   CHEMBL400767
ZINC  

Physicochemical Properties

Molecular Weight:  461.30
ALogP:  4.5924
MLogP:  4.1
XLogP:  6.534
# Rotatable Bonds:  17
Polar Surface Area:  80.97
# H-Bond Aceptor:  5
# H-Bond Donor:  3
# Rings:  3
# Heavy Atoms:  34

Download Data

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Source Organisms  
Biological Activities  
Similar NPs/Drugs