Natural Product: NPC230098

Natural Product ID:  NPC230098
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C32H47NO5
Standard InCHIKey:  ISEQNYHFMBKSNB-HOXVFRLBSA-N
Standard InCHI:  InChI=1S/C32H47NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-29(35)38-32-26(34)18-23-16-17-33-21-24-19-27-28(37-22-36-27)20-25(24)30(32)31(23)33/h18-20,26,30-32,34H,2-17,21-22H2,1H3/t26-,30-,31+,32+/m0/s1
Canonical SMILES:  CCCCCCCCCCCCCCCC(=O)O[C@@H]1[C@@H](O)C=C2[C@@H]3[C@@H]1c1cc4OCOc4cc1CN3CC2
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
NPO9144 Atriplex parvifolia Species Chenopodiaceae Eukaryota UNPD*
NPO11473 Viburnum lantana Species Adoxaceae Eukaryota UNPD*
NPO19776 Hesperocyparis arizonica Species Cupressaceae Eukaryota UNPD*
NPO3630 Crotalaria crispata Species Fabaceae Eukaryota UNPD*
NPO9927 Crinum asiaticum Species Amaryllidaceae Eukaryota UNPD*
NPO11000 Eupatorium laevigatum Species Asteraceae Eukaryota UNPD*
NPO1412 Artemisia juncea Species Asteraceae Eukaryota UNPD*
NPO9485 Haplopappus deserticola Species Asteraceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified GI50 = 27000 nM 22019045
NPT83 Cell Line MCF7 Homo sapiens GI50 = 32000 nM 22019045
NPT169 Cell Line B16-F10 Mus musculus GI50 = 28000 nM 22019045
NPT2 Others Unspecified GI50 = 24000 nM 22019045
NPT1125 Cell Line T98G Homo sapiens GI50 = 7000 nM 22019045
NPT81 Cell Line A549 Homo sapiens GI50 = 26000 nM 22019045
NPT170 Cell Line SK-MEL-28 Homo sapiens GI50 = 35000 nM 22019045
NPT306 Cell Line PC-3 Homo sapiens GI50 = 29000 nM 22019045

  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 NPC230098 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
0.9701 High Similarity NPC474745
0.9641 High Similarity NPC474325
0.9581 High Similarity NPC237044
0.9529 High Similarity NPC475981
0.9529 High Similarity NPC474746
0.9521 High Similarity NPC304675
0.9341 High Similarity NPC474708
0.9281 High Similarity NPC475845
0.9222 High Similarity NPC57812
0.9222 High Similarity NPC474324
0.9222 High Similarity NPC190332
0.9222 High Similarity NPC181653
0.9107 High Similarity NPC100566
0.9042 High Similarity NPC320104
0.9012 High Similarity NPC474470
0.8994 High Similarity NPC33256
0.8728 High Similarity NPC470739
0.8728 High Similarity NPC225597
0.8728 High Similarity NPC477640
0.8721 High Similarity NPC158148
0.8721 High Similarity NPC82533
0.8721 High Similarity NPC475686
0.8721 High Similarity NPC58766
0.8721 High Similarity NPC290759
0.8721 High Similarity NPC266176
0.8698 High Similarity NPC249274
0.8698 High Similarity NPC205167
0.8698 High Similarity NPC4304
0.8671 High Similarity NPC311991
0.8671 High Similarity NPC474475
0.8629 High Similarity NPC187678
0.8605 High Similarity NPC476002
0.8588 High Similarity NPC97072
0.8588 High Similarity NPC215829
0.8564 High Similarity NPC80472
0.8531 High Similarity NPC118633
0.8531 High Similarity NPC294790
0.8531 High Similarity NPC15919
0.8531 High Similarity NPC148693
0.8453 Intermediate Similarity NPC162694
0.838 Intermediate Similarity NPC244554
0.837 Intermediate Similarity NPC94499
0.8353 Intermediate Similarity NPC78733
0.8343 Intermediate Similarity NPC252960
0.8315 Intermediate Similarity NPC319549
0.8305 Intermediate Similarity NPC65403
0.8297 Intermediate Similarity NPC9867
0.8287 Intermediate Similarity NPC102760
0.8276 Intermediate Similarity NPC218614
0.8268 Intermediate Similarity NPC35680
0.8258 Intermediate Similarity NPC2314
0.8249 Intermediate Similarity NPC75958
0.8235 Intermediate Similarity NPC223124
0.8229 Intermediate Similarity NPC247972
0.8212 Intermediate Similarity NPC49353
0.8198 Intermediate Similarity NPC147091
0.8187 Intermediate Similarity NPC275132
0.8148 Intermediate Similarity NPC267414
0.8129 Intermediate Similarity NPC148898
0.8125 Intermediate Similarity NPC180306
0.8118 Intermediate Similarity NPC226708
0.8118 Intermediate Similarity NPC63152
0.8118 Intermediate Similarity NPC223125
0.8111 Intermediate Similarity NPC128560
0.8111 Intermediate Similarity NPC199465
0.8111 Intermediate Similarity NPC229166
0.8108 Intermediate Similarity NPC141440
0.8103 Intermediate Similarity NPC59028
0.8103 Intermediate Similarity NPC92191
0.8103 Intermediate Similarity NPC111485
0.8095 Intermediate Similarity NPC70290
0.8095 Intermediate Similarity NPC215098
0.8095 Intermediate Similarity NPC124302
0.8095 Intermediate Similarity NPC73020
0.8095 Intermediate Similarity NPC14622
0.8095 Intermediate Similarity NPC46744
0.8087 Intermediate Similarity NPC116284
0.8087 Intermediate Similarity NPC248642
0.8077 Intermediate Similarity NPC32154
0.8077 Intermediate Similarity NPC126284
0.8066 Intermediate Similarity NPC241704
0.8043 Intermediate Similarity NPC156576
0.8034 Intermediate Similarity NPC210918
0.8023 Intermediate Similarity NPC232514
0.8023 Intermediate Similarity NPC276944
0.8023 Intermediate Similarity NPC238530
0.8023 Intermediate Similarity NPC233029
0.8023 Intermediate Similarity NPC231198
0.8023 Intermediate Similarity NPC210148
0.8022 Intermediate Similarity NPC114364
0.8022 Intermediate Similarity NPC320223
0.8021 Intermediate Similarity NPC202771
0.8021 Intermediate Similarity NPC286135
0.8021 Intermediate Similarity NPC328700
0.8021 Intermediate Similarity NPC119818
0.8021 Intermediate Similarity NPC2173
0.8012 Intermediate Similarity NPC274026
0.8011 Intermediate Similarity NPC166979
0.801 Intermediate Similarity NPC120671
0.801 Intermediate Similarity NPC72788
0.801 Intermediate Similarity NPC314100
0.801 Intermediate Similarity NPC226652
0.8 Intermediate Similarity NPC477080
0.8 Intermediate Similarity NPC475959
0.7955 Intermediate Similarity NPC165797
0.7944 Intermediate Similarity NPC474953
0.7933 Intermediate Similarity NPC150879
0.7933 Intermediate Similarity NPC298186
0.7933 Intermediate Similarity NPC301189
0.7921 Intermediate Similarity NPC16805
0.7921 Intermediate Similarity NPC167546
0.7921 Intermediate Similarity NPC302527
0.7919 Intermediate Similarity NPC82285
0.7919 Intermediate Similarity NPC133011
0.7914 Intermediate Similarity NPC237579
0.7892 Intermediate Similarity NPC233718
0.7886 Intermediate Similarity NPC146288
0.7886 Intermediate Similarity NPC234392
0.7886 Intermediate Similarity NPC31311
0.788 Intermediate Similarity NPC99179
0.7877 Intermediate Similarity NPC476432
0.7877 Intermediate Similarity NPC24264
0.7872 Intermediate Similarity NPC82763
0.7869 Intermediate Similarity NPC283999
0.7865 Intermediate Similarity NPC59567
0.7861 Intermediate Similarity NPC214116
0.7838 Intermediate Similarity NPC477561
0.7838 Intermediate Similarity NPC476574
0.7838 Intermediate Similarity NPC312918
0.7838 Intermediate Similarity NPC155442
0.7833 Intermediate Similarity NPC247389
0.7833 Intermediate Similarity NPC298979
0.7829 Intermediate Similarity NPC41178
0.7829 Intermediate Similarity NPC138487
0.7829 Intermediate Similarity NPC216459
0.7821 Intermediate Similarity NPC225774
0.7802 Intermediate Similarity NPC57272
0.7801 Intermediate Similarity NPC125924
0.7791 Intermediate Similarity NPC246587
0.7791 Intermediate Similarity NPC147390
0.7791 Intermediate Similarity NPC24233
0.7791 Intermediate Similarity NPC135538
0.7791 Intermediate Similarity NPC428
0.7791 Intermediate Similarity NPC476571
0.7789 Intermediate Similarity NPC24260
0.7784 Intermediate Similarity NPC27887
0.7778 Intermediate Similarity NPC124657
0.7778 Intermediate Similarity NPC219341
0.7765 Intermediate Similarity NPC233650
0.776 Intermediate Similarity NPC24228
0.7754 Intermediate Similarity NPC135772
0.7749 Intermediate Similarity NPC469816
0.7749 Intermediate Similarity NPC469815
0.7742 Intermediate Similarity NPC474607
0.7735 Intermediate Similarity NPC210140
0.7733 Intermediate Similarity NPC321505
0.7733 Intermediate Similarity NPC191376
0.7733 Intermediate Similarity NPC179825
0.7732 Intermediate Similarity NPC475654
0.7722 Intermediate Similarity NPC13504
0.7722 Intermediate Similarity NPC477563
0.7722 Intermediate Similarity NPC96603
0.7722 Intermediate Similarity NPC306843
0.7722 Intermediate Similarity NPC253043
0.7722 Intermediate Similarity NPC134858
0.7722 Intermediate Similarity NPC196447
0.7722 Intermediate Similarity NPC35345
0.7722 Intermediate Similarity NPC136508
0.7722 Intermediate Similarity NPC78222
0.7722 Intermediate Similarity NPC212794
0.7719 Intermediate Similarity NPC130926
0.7719 Intermediate Similarity NPC185838
0.7716 Intermediate Similarity NPC476500
0.7705 Intermediate Similarity NPC149090
0.7705 Intermediate Similarity NPC19520
0.7701 Intermediate Similarity NPC88249
0.7701 Intermediate Similarity NPC474650
0.7701 Intermediate Similarity NPC97221
0.7701 Intermediate Similarity NPC220858
0.7701 Intermediate Similarity NPC151895
0.7701 Intermediate Similarity NPC192768
0.7701 Intermediate Similarity NPC229234
0.7701 Intermediate Similarity NPC476575
0.7697 Intermediate Similarity NPC106786
0.7697 Intermediate Similarity NPC69360
0.7688 Intermediate Similarity NPC46990
0.7667 Intermediate Similarity NPC324144
0.7665 Intermediate Similarity NPC7018
0.7654 Intermediate Similarity NPC232924
0.7654 Intermediate Similarity NPC266753
0.7654 Intermediate Similarity NPC306902
0.7654 Intermediate Similarity NPC477559
0.7654 Intermediate Similarity NPC160298
0.765 Intermediate Similarity NPC6152
0.7644 Intermediate Similarity NPC475754
0.7644 Intermediate Similarity NPC477565
0.7644 Intermediate Similarity NPC103379
0.764 Intermediate Similarity NPC315707
0.764 Intermediate Similarity NPC475326
0.764 Intermediate Similarity NPC78359

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC230098 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
0.8315 Intermediate Similarity NPD7296 Approved
0.8232 Intermediate Similarity NPD7281 Phase 3
0.8232 Intermediate Similarity NPD7280 Phase 3
0.8187 Intermediate Similarity NPD7090 Clinical (unspecified phase)
0.8095 Intermediate Similarity NPD4420 Approved
0.8056 Intermediate Similarity NPD5312 Approved
0.8056 Intermediate Similarity NPD5313 Approved
0.8023 Intermediate Similarity NPD6107 Approved
0.8021 Intermediate Similarity NPD5006 Approved
0.8021 Intermediate Similarity NPD5005 Approved
0.802 Intermediate Similarity NPD7827 Phase 1
0.7977 Intermediate Similarity NPD4773 Phase 2
0.7977 Intermediate Similarity NPD4772 Phase 2
0.7953 Intermediate Similarity NPD3640 Phase 3
0.7953 Intermediate Similarity NPD3641 Approved
0.7953 Intermediate Similarity NPD3639 Approved
0.7933 Intermediate Similarity NPD2969 Approved
0.7933 Intermediate Similarity NPD2970 Approved
0.7889 Intermediate Similarity NPD4481 Phase 3
0.7865 Intermediate Similarity NPD7237 Clinical (unspecified phase)
0.7801 Intermediate Similarity NPD7667 Clinical (unspecified phase)
0.779 Intermediate Similarity NPD27 Approved
0.779 Intermediate Similarity NPD2489 Approved
0.7778 Intermediate Similarity NPD3051 Approved
0.7778 Intermediate Similarity NPD6071 Discontinued
0.7701 Intermediate Similarity NPD6851 Approved
0.7701 Intermediate Similarity NPD6853 Approved
0.7684 Intermediate Similarity NPD2490 Approved
0.7684 Intermediate Similarity NPD2488 Approved
0.764 Intermediate Similarity NPD2563 Approved
0.764 Intermediate Similarity NPD2560 Approved
0.7588 Intermediate Similarity NPD4664 Clinical (unspecified phase)
0.7581 Intermediate Similarity NPD6297 Approved
0.7553 Intermediate Similarity NPD7313 Approved
0.7553 Intermediate Similarity NPD7312 Approved
0.7553 Intermediate Similarity NPD7311 Approved
0.7553 Intermediate Similarity NPD2971 Approved
0.7553 Intermediate Similarity NPD7310 Approved
0.7553 Intermediate Similarity NPD2968 Approved
0.7513 Intermediate Similarity NPD7309 Approved
0.75 Intermediate Similarity NPD4966 Approved
0.75 Intermediate Similarity NPD2898 Approved
0.75 Intermediate Similarity NPD4965 Approved
0.75 Intermediate Similarity NPD4967 Phase 2
0.7487 Intermediate Similarity NPD7906 Approved
0.7486 Intermediate Similarity NPD6818 Clinical (unspecified phase)
0.7475 Intermediate Similarity NPD3057 Approved
0.7457 Intermediate Similarity NPD5084 Clinical (unspecified phase)
0.7436 Intermediate Similarity NPD5582 Discontinued
0.7429 Intermediate Similarity NPD4584 Approved
0.7424 Intermediate Similarity NPD2494 Approved
0.7424 Intermediate Similarity NPD2493 Approved
0.7424 Intermediate Similarity NPD3450 Approved
0.7424 Intermediate Similarity NPD3452 Approved
0.7421 Intermediate Similarity NPD8054 Approved
0.7421 Intermediate Similarity NPD8053 Approved
0.7419 Intermediate Similarity NPD7228 Approved
0.7418 Intermediate Similarity NPD6234 Discontinued
0.7409 Intermediate Similarity NPD5525 Clinical (unspecified phase)
0.74 Intermediate Similarity NPD4582 Approved
0.74 Intermediate Similarity NPD4583 Approved
0.7398 Intermediate Similarity NPD2974 Approved
0.7398 Intermediate Similarity NPD2975 Approved
0.7398 Intermediate Similarity NPD2973 Approved
0.7391 Intermediate Similarity NPD4166 Phase 2
0.7389 Intermediate Similarity NPD5773 Approved
0.7389 Intermediate Similarity NPD5772 Approved
0.7389 Intermediate Similarity NPD2977 Approved
0.7389 Intermediate Similarity NPD2978 Approved
0.7387 Intermediate Similarity NPD3533 Approved
0.7387 Intermediate Similarity NPD2972 Approved
0.7381 Intermediate Similarity NPD5619 Clinical (unspecified phase)
0.7374 Intermediate Similarity NPD4580 Approved
0.7374 Intermediate Similarity NPD4107 Approved
0.7368 Intermediate Similarity NPD3534 Clinical (unspecified phase)
0.7363 Intermediate Similarity NPD7832 Clinical (unspecified phase)
0.7363 Intermediate Similarity NPD7831 Phase 2
0.7363 Intermediate Similarity NPD7833 Phase 2
0.7358 Intermediate Similarity NPD7235 Clinical (unspecified phase)
0.735 Intermediate Similarity NPD4002 Approved
0.735 Intermediate Similarity NPD4004 Approved
0.7349 Intermediate Similarity NPD6723 Discontinued
0.7344 Intermediate Similarity NPD4663 Approved
0.7341 Intermediate Similarity NPD4237 Approved
0.7341 Intermediate Similarity NPD4236 Phase 3
0.7333 Intermediate Similarity NPD37 Approved
0.7333 Intermediate Similarity NPD6997 Phase 2
0.7303 Intermediate Similarity NPD4210 Discontinued
0.73 Intermediate Similarity NPD2491 Approved
0.73 Intermediate Similarity NPD3448 Approved
0.7287 Intermediate Similarity NPD8156 Discontinued
0.7278 Intermediate Similarity NPD6385 Approved
0.7278 Intermediate Similarity NPD6386 Approved
0.7277 Intermediate Similarity NPD4577 Approved
0.7277 Intermediate Similarity NPD4578 Approved
0.7257 Intermediate Similarity NPD5241 Discontinued
0.725 Intermediate Similarity NPD4482 Phase 3
0.7238 Intermediate Similarity NPD7298 Approved
0.7234 Intermediate Similarity NPD8099 Discontinued
0.7234 Intermediate Similarity NPD8252 Approved
0.7234 Intermediate Similarity NPD8251 Approved
0.7231 Intermediate Similarity NPD3808 Clinical (unspecified phase)
0.7228 Intermediate Similarity NPD4040 Phase 1
0.7216 Intermediate Similarity NPD7243 Clinical (unspecified phase)
0.7216 Intermediate Similarity NPD6783 Clinical (unspecified phase)
0.7216 Intermediate Similarity NPD6667 Approved
0.7216 Intermediate Similarity NPD6666 Approved
0.7204 Intermediate Similarity NPD4010 Discontinued
0.7192 Intermediate Similarity NPD7999 Approved
0.7189 Intermediate Similarity NPD6625 Approved
0.7184 Intermediate Similarity NPD5676 Approved
0.7178 Intermediate Similarity NPD7497 Discontinued
0.7173 Intermediate Similarity NPD7240 Approved
0.7158 Intermediate Similarity NPD5977 Approved
0.7158 Intermediate Similarity NPD5978 Approved
0.7143 Intermediate Similarity NPD7945 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD7132 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD1754 Clinical (unspecified phase)
0.7129 Intermediate Similarity NPD7047 Phase 3
0.7122 Intermediate Similarity NPD4859 Phase 1
0.7111 Intermediate Similarity NPD3687 Approved
0.7111 Intermediate Similarity NPD3686 Approved
0.7108 Intermediate Similarity NPD7607 Clinical (unspecified phase)
0.7088 Intermediate Similarity NPD7109 Clinical (unspecified phase)
0.7088 Intermediate Similarity NPD7110 Phase 1
0.7083 Intermediate Similarity NPD7038 Approved
0.7083 Intermediate Similarity NPD7039 Approved
0.7081 Intermediate Similarity NPD7930 Approved
0.7081 Intermediate Similarity NPD5604 Discontinued
0.708 Intermediate Similarity NPD8152 Approved
0.708 Intermediate Similarity NPD8153 Approved
0.7079 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7072 Intermediate Similarity NPD4017 Approved
0.7059 Intermediate Similarity NPD7199 Phase 2
0.7056 Intermediate Similarity NPD6031 Approved
0.7056 Intermediate Similarity NPD6030 Approved
0.7042 Intermediate Similarity NPD7907 Approved
0.7041 Intermediate Similarity NPD7291 Discontinued
0.7026 Intermediate Similarity NPD5087 Clinical (unspecified phase)
0.7021 Intermediate Similarity NPD7315 Approved
0.7005 Intermediate Similarity NPD7201 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD2669 Clinical (unspecified phase)
0.6984 Remote Similarity NPD5242 Approved
0.6973 Remote Similarity NPD5353 Approved
0.6961 Remote Similarity NPD7427 Discontinued
0.6961 Remote Similarity NPD4727 Phase 1
0.6952 Remote Similarity NPD6315 Phase 2
0.6952 Remote Similarity NPD7571 Clinical (unspecified phase)
0.6948 Remote Similarity NPD8318 Clinical (unspecified phase)
0.6948 Remote Similarity NPD4665 Approved
0.6948 Remote Similarity NPD4111 Phase 1
0.6944 Remote Similarity NPD8389 Clinical (unspecified phase)
0.694 Remote Similarity NPD6876 Approved
0.694 Remote Similarity NPD6875 Approved
0.6937 Remote Similarity NPD7048 Phase 3
0.6932 Remote Similarity NPD3656 Approved
0.6915 Remote Similarity NPD2042 Clinical (unspecified phase)
0.6915 Remote Similarity NPD2904 Discontinued
0.6915 Remote Similarity NPD2041 Clinical (unspecified phase)
0.6915 Remote Similarity NPD4666 Phase 3
0.6906 Remote Similarity NPD3647 Clinical (unspecified phase)
0.6904 Remote Similarity NPD3857 Clinical (unspecified phase)
0.6902 Remote Similarity NPD6873 Phase 2
0.6902 Remote Similarity NPD6677 Suspended
0.6897 Remote Similarity NPD7811 Phase 3
0.6897 Remote Similarity NPD7810 Phase 3
0.6895 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6885 Remote Similarity NPD824 Approved
0.6884 Remote Similarity NPD8155 Clinical (unspecified phase)
0.6881 Remote Similarity NPD5564 Approved
0.6872 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6869 Remote Similarity NPD6842 Approved
0.6869 Remote Similarity NPD6841 Approved
0.6869 Remote Similarity NPD6843 Phase 3
0.6868 Remote Similarity NPD1670 Discontinued
0.6868 Remote Similarity NPD6662 Clinical (unspecified phase)
0.6865 Remote Similarity NPD7248 Discontinued
0.6862 Remote Similarity NPD5709 Phase 3
0.6854 Remote Similarity NPD5177 Phase 3
0.6854 Remote Similarity NPD5980 Discovery
0.6854 Remote Similarity NPD3060 Approved
0.6853 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6848 Remote Similarity NPD1337 Clinical (unspecified phase)
0.6845 Remote Similarity NPD6788 Approved
0.6834 Remote Similarity NPD6377 Clinical (unspecified phase)
0.6825 Remote Similarity NPD5677 Discontinued
0.6821 Remote Similarity NPD554 Clinical (unspecified phase)
0.6818 Remote Similarity NPD6028 Clinical (unspecified phase)
0.6818 Remote Similarity NPD6029 Clinical (unspecified phase)
0.6816 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6816 Remote Similarity NPD4110 Phase 3
0.6816 Remote Similarity NPD5754 Discontinued
0.6814 Remote Similarity NPD7565 Approved
0.6809 Remote Similarity NPD8005 Clinical (unspecified phase)
0.6809 Remote Similarity NPD7975 Clinical (unspecified phase)
0.6806 Remote Similarity NPD6688 Approved
0.6806 Remote Similarity NPD6687 Approved
0.6806 Remote Similarity NPD8051 Clinical (unspecified phase)
0.6802 Remote Similarity NPD6618 Phase 2
0.68 Remote Similarity NPD2492 Phase 1

Structure

External Identifiers

PubChem CID   54764247
ChEMBL   CHEMBL1922157
ZINC  

Physicochemical Properties

Molecular Weight:  525.35
ALogP:  -4.4051
MLogP:  4.32
XLogP:  8.164
# Rotatable Bonds:  18
Polar Surface Area:  68.23
# H-Bond Aceptor:  4
# H-Bond Donor:  1
# Rings:  5
# Heavy Atoms:  38

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Biological Activities  
Similar NPs/Drugs