Natural Product: NPC477175

Natural Product ID:  NPC477175
Common Name:   Gliocladine C
IUPAC Name:  
Synonyms:   Gliocladine C
Molecular Formula:   C23H20N4O3S2
Standard InCHIKey:  MRBZKCMQZBKXMZ-HMKLVTIHSA-N
Standard InCHI:  InChI=1S/C23H20N4O3S2/c1-21-19(29)27-18-22(13-8-4-6-10-16(13)25-18,14-11-24-15-9-5-3-7-12(14)15)17(28)23(27,32-31-21)20(30)26(21)2/h3-11,17-18,24-25,28H,1-2H3/t17-,18+,21+,22+,23-/m0/s1
Canonical SMILES:  O=C1N(C)[C@]2(C)SS[C@@]31N(C2=O)[C@@H]1[C@]([C@@H]3O)(c2c(N1)cccc2)c1c[nH]c2c1cccc2
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
NPO33665 Gliocladium roseum Species Eukaryota isolated from submerged wood, collected from fresh water Yunnan Province, China PMID[16252916]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT530 Organism Caenorhabditis elegans Caenorhabditis elegans ED50 = 200 ug/ml 16252916
NPT1272 Organism Panagrellus redivivus Panagrellus redivivus ED50 = 250 ug/ml 16252916
NPT593 Organism Bursaphelenchus xylophilus Bursaphelenchus xylophilus ED50 > 400 ug/ml 16252916

  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 NPC477175 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
1.0 High Similarity NPC470730
0.9951 High Similarity NPC475969
0.9951 High Similarity NPC475859
0.9902 High Similarity NPC165743
0.9709 High Similarity NPC470729
0.9709 High Similarity NPC477176
0.9662 High Similarity NPC474877
0.9662 High Similarity NPC477177
0.9569 High Similarity NPC63279
0.9524 High Similarity NPC297642
0.9409 High Similarity NPC470731
0.9126 High Similarity NPC470732
0.8692 High Similarity NPC312942
0.8692 High Similarity NPC327095
0.8651 High Similarity NPC40455
0.8611 High Similarity NPC19170
0.8493 Intermediate Similarity NPC297862
0.8479 Intermediate Similarity NPC476817
0.8389 Intermediate Similarity NPC162860
0.8341 Intermediate Similarity NPC272174
0.8294 Intermediate Similarity NPC54420
0.8265 Intermediate Similarity NPC253987
0.8219 Intermediate Similarity NPC474896
0.8182 Intermediate Similarity NPC31097
0.8131 Intermediate Similarity NPC107077
0.8131 Intermediate Similarity NPC223791
0.8111 Intermediate Similarity NPC478157
0.8082 Intermediate Similarity NPC477714
0.8057 Intermediate Similarity NPC475506
0.8047 Intermediate Similarity NPC478158
0.8037 Intermediate Similarity NPC477715
0.8019 Intermediate Similarity NPC155143
0.8 Intermediate Similarity NPC171317
0.8 Intermediate Similarity NPC281049
0.8 Intermediate Similarity NPC14812
0.7981 Intermediate Similarity NPC477179
0.7948 Intermediate Similarity NPC478028
0.7944 Intermediate Similarity NPC254850
0.7944 Intermediate Similarity NPC477181
0.7944 Intermediate Similarity NPC477178
0.7944 Intermediate Similarity NPC477180
0.7915 Intermediate Similarity NPC473640
0.7913 Intermediate Similarity NPC17059
0.7907 Intermediate Similarity NPC477173
0.7907 Intermediate Similarity NPC477174
0.7907 Intermediate Similarity NPC470490
0.79 Intermediate Similarity NPC54744
0.789 Intermediate Similarity NPC320968
0.7879 Intermediate Similarity NPC478029
0.787 Intermediate Similarity NPC470488
0.7864 Intermediate Similarity NPC94752
0.786 Intermediate Similarity NPC473376
0.7854 Intermediate Similarity NPC75634
0.7838 Intermediate Similarity NPC475736
0.7834 Intermediate Similarity NPC471945
0.7834 Intermediate Similarity NPC475259
0.7834 Intermediate Similarity NPC470491
0.7834 Intermediate Similarity NPC471950
0.7798 Intermediate Similarity NPC471946
0.7798 Intermediate Similarity NPC471951
0.7788 Intermediate Similarity NPC213629
0.7773 Intermediate Similarity NPC294693
0.7763 Intermediate Similarity NPC56109
0.7763 Intermediate Similarity NPC475359
0.7763 Intermediate Similarity NPC191382
0.7763 Intermediate Similarity NPC191817
0.7757 Intermediate Similarity NPC470497
0.7743 Intermediate Similarity NPC64216
0.7739 Intermediate Similarity NPC89987
0.771 Intermediate Similarity NPC100321
0.7709 Intermediate Similarity NPC474196
0.7699 Intermediate Similarity NPC155444
0.7692 Intermediate Similarity NPC110602
0.7692 Intermediate Similarity NPC75726
0.7692 Intermediate Similarity NPC31385
0.7689 Intermediate Similarity NPC474195
0.7681 Intermediate Similarity NPC228835
0.7672 Intermediate Similarity NPC325976
0.7652 Intermediate Similarity NPC69843
0.7642 Intermediate Similarity NPC125181
0.7642 Intermediate Similarity NPC242872
0.7642 Intermediate Similarity NPC263117
0.7628 Intermediate Similarity NPC293917
0.7619 Intermediate Similarity NPC321708
0.7615 Intermediate Similarity NPC470489
0.76 Intermediate Similarity NPC473310
0.7581 Intermediate Similarity NPC131887
0.7581 Intermediate Similarity NPC52557
0.7576 Intermediate Similarity NPC326363
0.7573 Intermediate Similarity NPC11126
0.757 Intermediate Similarity NPC321939
0.7565 Intermediate Similarity NPC476491
0.756 Intermediate Similarity NPC15102
0.7558 Intermediate Similarity NPC300183
0.7556 Intermediate Similarity NPC472285
0.7536 Intermediate Similarity NPC175474
0.7536 Intermediate Similarity NPC91179
0.7523 Intermediate Similarity NPC476874
0.7522 Intermediate Similarity NPC24370
0.7522 Intermediate Similarity NPC319232
0.7512 Intermediate Similarity NPC79129
0.7512 Intermediate Similarity NPC81654
0.7512 Intermediate Similarity NPC195461
0.7512 Intermediate Similarity NPC249150
0.7512 Intermediate Similarity NPC49196
0.7512 Intermediate Similarity NPC252338
0.7512 Intermediate Similarity NPC313985
0.7512 Intermediate Similarity NPC472294
0.7511 Intermediate Similarity NPC471192
0.751 Intermediate Similarity NPC478006
0.75 Intermediate Similarity NPC50503
0.75 Intermediate Similarity NPC478011
0.75 Intermediate Similarity NPC478012
0.75 Intermediate Similarity NPC314056
0.749 Intermediate Similarity NPC314882
0.7489 Intermediate Similarity NPC54981
0.7489 Intermediate Similarity NPC475258
0.7478 Intermediate Similarity NPC238945
0.747 Intermediate Similarity NPC314176
0.747 Intermediate Similarity NPC315467
0.7466 Intermediate Similarity NPC323927
0.7465 Intermediate Similarity NPC117244
0.7465 Intermediate Similarity NPC473763
0.7463 Intermediate Similarity NPC161861
0.7458 Intermediate Similarity NPC28945
0.7455 Intermediate Similarity NPC153980
0.7455 Intermediate Similarity NPC6865
0.7455 Intermediate Similarity NPC471194
0.7455 Intermediate Similarity NPC471193
0.7454 Intermediate Similarity NPC227582
0.7443 Intermediate Similarity NPC193761
0.7443 Intermediate Similarity NPC476073
0.7441 Intermediate Similarity NPC315555
0.744 Intermediate Similarity NPC478009
0.744 Intermediate Similarity NPC478010
0.7436 Intermediate Similarity NPC63031
0.7426 Intermediate Similarity NPC470784
0.7422 Intermediate Similarity NPC475602
0.7419 Intermediate Similarity NPC470499
0.7418 Intermediate Similarity NPC95783
0.7418 Intermediate Similarity NPC128582
0.7415 Intermediate Similarity NPC477549
0.7411 Intermediate Similarity NPC72956
0.7411 Intermediate Similarity NPC82370
0.741 Intermediate Similarity NPC478013
0.7406 Intermediate Similarity NPC17487
0.7406 Intermediate Similarity NPC201831
0.7404 Intermediate Similarity NPC248041
0.7404 Intermediate Similarity NPC248462
0.7404 Intermediate Similarity NPC126709
0.7384 Intermediate Similarity NPC184680
0.7382 Intermediate Similarity NPC33949
0.7375 Intermediate Similarity NPC477107
0.7375 Intermediate Similarity NPC477109
0.7375 Intermediate Similarity NPC477108
0.7371 Intermediate Similarity NPC475338
0.7371 Intermediate Similarity NPC909
0.7366 Intermediate Similarity NPC475422
0.7366 Intermediate Similarity NPC234999
0.7364 Intermediate Similarity NPC260900
0.7358 Intermediate Similarity NPC62749
0.7356 Intermediate Similarity NPC145885
0.7356 Intermediate Similarity NPC14113
0.7356 Intermediate Similarity NPC84827
0.7356 Intermediate Similarity NPC64436
0.7354 Intermediate Similarity NPC71238
0.7354 Intermediate Similarity NPC87755
0.7353 Intermediate Similarity NPC470785
0.7348 Intermediate Similarity NPC471506
0.7345 Intermediate Similarity NPC229348
0.7342 Intermediate Similarity NPC277350
0.7331 Intermediate Similarity NPC220852
0.7331 Intermediate Similarity NPC323752
0.733 Intermediate Similarity NPC98715
0.733 Intermediate Similarity NPC317701
0.7321 Intermediate Similarity NPC283219
0.7321 Intermediate Similarity NPC219336
0.7317 Intermediate Similarity NPC317430
0.7313 Intermediate Similarity NPC474412
0.7311 Intermediate Similarity NPC308931
0.7311 Intermediate Similarity NPC285343
0.7311 Intermediate Similarity NPC99939
0.7311 Intermediate Similarity NPC184225
0.7309 Intermediate Similarity NPC166492
0.7309 Intermediate Similarity NPC473362
0.7308 Intermediate Similarity NPC267885
0.7306 Intermediate Similarity NPC153400
0.7286 Intermediate Similarity NPC16659
0.7286 Intermediate Similarity NPC15840
0.7284 Intermediate Similarity NPC229893
0.7281 Intermediate Similarity NPC36405
0.7281 Intermediate Similarity NPC472027
0.7277 Intermediate Similarity NPC135601
0.7277 Intermediate Similarity NPC141612
0.7277 Intermediate Similarity NPC17273
0.7277 Intermediate Similarity NPC478077
0.7277 Intermediate Similarity NPC235684
0.7277 Intermediate Similarity NPC314957
0.7273 Intermediate Similarity NPC15573
0.7273 Intermediate Similarity NPC217372

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC477175 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
0.8102 Intermediate Similarity NPD7594 Clinical (unspecified phase)
0.8009 Intermediate Similarity NPD7809 Clinical (unspecified phase)
0.7965 Intermediate Similarity NPD7824 Approved
0.7953 Intermediate Similarity NPD8493 Clinical (unspecified phase)
0.7939 Intermediate Similarity NPD7951 Approved
0.7939 Intermediate Similarity NPD7950 Approved
0.7939 Intermediate Similarity NPD7790 Approved
0.7939 Intermediate Similarity NPD7789 Approved
0.7939 Intermediate Similarity NPD7953 Approved
0.7939 Intermediate Similarity NPD7952 Approved
0.7939 Intermediate Similarity NPD7791 Approved
0.7876 Intermediate Similarity NPD7730 Approved
0.7876 Intermediate Similarity NPD7731 Approved
0.7867 Intermediate Similarity NPD7271 Approved
0.7797 Intermediate Similarity NPD6164 Phase 2
0.7797 Intermediate Similarity NPD6165 Phase 2
0.7788 Intermediate Similarity NPD6838 Clinical (unspecified phase)
0.7783 Intermediate Similarity NPD7970 Approved
0.7783 Intermediate Similarity NPD7971 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD5426 Phase 3
0.7773 Intermediate Similarity NPD7618 Phase 3
0.7773 Intermediate Similarity NPD7619 Phase 3
0.7763 Intermediate Similarity NPD7781 Approved
0.7763 Intermediate Similarity NPD7780 Approved
0.7727 Intermediate Similarity NPD7470 Discontinued
0.7628 Intermediate Similarity NPD7621 Clinical (unspecified phase)
0.7615 Intermediate Similarity NPD8272 Phase 2
0.7606 Intermediate Similarity NPD7944 Discontinued
0.7591 Intermediate Similarity NPD7666 Phase 3
0.7591 Intermediate Similarity NPD7665 Phase 2
0.758 Intermediate Similarity NPD7001 Phase 3
0.7558 Intermediate Similarity NPD7903 Clinical (unspecified phase)
0.7512 Intermediate Similarity NPD4601 Approved
0.7512 Intermediate Similarity NPD4600 Approved
0.75 Intermediate Similarity NPD8094 Discontinued
0.7489 Intermediate Similarity NPD8013 Clinical (unspecified phase)
0.7466 Intermediate Similarity NPD8322 Phase 2
0.7465 Intermediate Similarity NPD6999 Discontinued
0.7465 Intermediate Similarity NPD7000 Clinical (unspecified phase)
0.7455 Intermediate Similarity NPD8093 Discontinued
0.7452 Intermediate Similarity NPD6595 Phase 3
0.7446 Intermediate Similarity NPD7711 Discontinued
0.7445 Intermediate Similarity NPD8405 Clinical (unspecified phase)
0.7371 Intermediate Similarity NPD8289 Discontinued
0.7371 Intermediate Similarity NPD7603 Discontinued
0.7366 Intermediate Similarity NPD7998 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD6732 Clinical (unspecified phase)
0.7325 Intermediate Similarity NPD7823 Clinical (unspecified phase)
0.7325 Intermediate Similarity NPD8406 Clinical (unspecified phase)
0.7311 Intermediate Similarity NPD6610 Clinical (unspecified phase)
0.7308 Intermediate Similarity NPD749 Clinical (unspecified phase)
0.7299 Intermediate Similarity NPD2095 Phase 2
0.7299 Intermediate Similarity NPD5728 Clinical (unspecified phase)
0.7299 Intermediate Similarity NPD2092 Phase 2
0.7299 Intermediate Similarity NPD2094 Phase 2
0.7297 Intermediate Similarity NPD7712 Clinical (unspecified phase)
0.7297 Intermediate Similarity NPD8114 Approved
0.7297 Intermediate Similarity NPD8115 Approved
0.7281 Intermediate Similarity NPD7543 Phase 2
0.7269 Intermediate Similarity NPD8488 Clinical (unspecified phase)
0.7264 Intermediate Similarity NPD2091 Phase 2
0.7264 Intermediate Similarity NPD2096 Phase 2
0.726 Intermediate Similarity NPD482 Approved
0.7249 Intermediate Similarity NPD8000 Clinical (unspecified phase)
0.7243 Intermediate Similarity NPD6141 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD8458 Clinical (unspecified phase)
0.7212 Intermediate Similarity NPD7825 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD4602 Approved
0.7186 Intermediate Similarity NPD7168 Phase 3
0.7169 Intermediate Similarity NPD6449 Clinical (unspecified phase)
0.7163 Intermediate Similarity NPD3486 Clinical (unspecified phase)
0.7162 Intermediate Similarity NPD7817 Phase 1
0.7162 Intermediate Similarity NPD8112 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD8169 Discontinued
0.7137 Intermediate Similarity NPD6173 Approved
0.7136 Intermediate Similarity NPD6664 Approved
0.713 Intermediate Similarity NPD6268 Phase 1
0.713 Intermediate Similarity NPD6269 Clinical (unspecified phase)
0.713 Intermediate Similarity NPD8110 Clinical (unspecified phase)
0.7129 Intermediate Similarity NPD750 Phase 2
0.7124 Intermediate Similarity NPD2510 Approved
0.7124 Intermediate Similarity NPD2509 Approved
0.7114 Intermediate Similarity NPD4558 Phase 2
0.7113 Intermediate Similarity NPD7415 Suspended
0.7112 Intermediate Similarity NPD5198 Approved
0.7112 Intermediate Similarity NPD5199 Approved
0.7111 Intermediate Similarity NPD7957 Phase 1
0.7111 Intermediate Similarity NPD4862 Clinical (unspecified phase)
0.7111 Intermediate Similarity NPD7958 Clinical (unspecified phase)
0.7109 Intermediate Similarity NPD6203 Clinical (unspecified phase)
0.71 Intermediate Similarity NPD8271 Discontinued
0.7098 Intermediate Similarity NPD8072 Approved
0.7095 Intermediate Similarity NPD5065 Approved
0.7083 Intermediate Similarity NPD3961 Discontinued
0.7073 Intermediate Similarity NPD2511 Approved
0.7067 Intermediate Similarity NPD5901 Discontinued
0.7064 Intermediate Similarity NPD7716 Approved
0.7064 Intermediate Similarity NPD7717 Approved
0.7059 Intermediate Similarity NPD2880 Discontinued
0.7056 Intermediate Similarity NPD3394 Approved
0.7056 Intermediate Similarity NPD3389 Approved
0.7056 Intermediate Similarity NPD3393 Approved
0.7054 Intermediate Similarity NPD8073 Approved
0.7051 Intermediate Similarity NPD6965 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD8464 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD5040 Clinical (unspecified phase)
0.704 Intermediate Similarity NPD4500 Approved
0.704 Intermediate Similarity NPD4501 Approved
0.7037 Intermediate Similarity NPD7026 Phase 2
0.7032 Intermediate Similarity NPD6665 Discontinued
0.7026 Intermediate Similarity NPD2787 Clinical (unspecified phase)
0.7009 Intermediate Similarity NPD7727 Phase 2
0.7009 Intermediate Similarity NPD5017 Discontinued
0.7004 Intermediate Similarity NPD8250 Phase 2
0.7004 Intermediate Similarity NPD8410 Clinical (unspecified phase)
0.6995 Remote Similarity NPD4079 Approved
0.6995 Remote Similarity NPD4076 Approved
0.6986 Remote Similarity NPD6180 Clinical (unspecified phase)
0.6986 Remote Similarity NPD8240 Discontinued
0.6982 Remote Similarity NPD5003 Discontinued
0.6978 Remote Similarity NPD5721 Clinical (unspecified phase)
0.6974 Remote Similarity NPD2443 Approved
0.6974 Remote Similarity NPD2442 Approved
0.6963 Remote Similarity NPD6277 Clinical (unspecified phase)
0.6959 Remote Similarity NPD5820 Clinical (unspecified phase)
0.6959 Remote Similarity NPD4426 Clinical (unspecified phase)
0.6952 Remote Similarity NPD4184 Clinical (unspecified phase)
0.6949 Remote Similarity NPD6995 Phase 1
0.6948 Remote Similarity NPD3506 Approved
0.6948 Remote Similarity NPD3505 Approved
0.6947 Remote Similarity NPD2121 Clinical (unspecified phase)
0.6944 Remote Similarity NPD6178 Phase 3
0.6941 Remote Similarity NPD4499 Approved
0.6936 Remote Similarity NPD5884 Clinical (unspecified phase)
0.6933 Remote Similarity NPD7426 Phase 1
0.6929 Remote Similarity NPD8119 Discontinued
0.6929 Remote Similarity NPD6263 Clinical (unspecified phase)
0.6929 Remote Similarity NPD4885 Approved
0.6927 Remote Similarity NPD8431 Approved
0.6926 Remote Similarity NPD7195 Clinical (unspecified phase)
0.692 Remote Similarity NPD7202 Clinical (unspecified phase)
0.6908 Remote Similarity NPD6454 Clinical (unspecified phase)
0.6907 Remote Similarity NPD6615 Clinical (unspecified phase)
0.6905 Remote Similarity NPD8246 Approved
0.6905 Remote Similarity NPD5069 Clinical (unspecified phase)
0.6905 Remote Similarity NPD8247 Approved
0.6901 Remote Similarity NPD6044 Discontinued
0.69 Remote Similarity NPD7947 Clinical (unspecified phase)
0.6897 Remote Similarity NPD7557 Clinical (unspecified phase)
0.6894 Remote Similarity NPD4555 Clinical (unspecified phase)
0.6889 Remote Similarity NPD484 Approved
0.6886 Remote Similarity NPD7568 Phase 1
0.688 Remote Similarity NPD8257 Approved
0.688 Remote Similarity NPD8258 Clinical (unspecified phase)
0.688 Remote Similarity NPD8256 Approved
0.6878 Remote Similarity NPD8356 Approved
0.6877 Remote Similarity NPD8349 Phase 1
0.6875 Remote Similarity NPD4397 Phase 1
0.6872 Remote Similarity NPD6970 Phase 2
0.6872 Remote Similarity NPD6176 Phase 1
0.687 Remote Similarity NPD2125 Clinical (unspecified phase)
0.6866 Remote Similarity NPD7564 Discontinued
0.6861 Remote Similarity NPD7818 Clinical (unspecified phase)
0.6853 Remote Similarity NPD4852 Phase 2
0.6851 Remote Similarity NPD6578 Clinical (unspecified phase)
0.6844 Remote Similarity NPD6661 Clinical (unspecified phase)
0.6842 Remote Similarity NPD6288 Clinical (unspecified phase)
0.6842 Remote Similarity NPD3914 Clinical (unspecified phase)
0.6835 Remote Similarity NPD3082 Discontinued
0.6833 Remote Similarity NPD6630 Clinical (unspecified phase)
0.6833 Remote Similarity NPD5592 Clinical (unspecified phase)
0.6833 Remote Similarity NPD8430 Approved
0.6825 Remote Similarity NPD5862 Discovery
0.6822 Remote Similarity NPD8284 Discontinued
0.6818 Remote Similarity NPD8372 Clinical (unspecified phase)
0.6816 Remote Similarity NPD4998 Phase 3
0.6816 Remote Similarity NPD4999 Phase 3
0.6814 Remote Similarity NPD6479 Discontinued
0.6809 Remote Similarity NPD5818 Discontinued
0.6807 Remote Similarity NPD6824 Clinical (unspecified phase)
0.6805 Remote Similarity NPD5559 Phase 2
0.6798 Remote Similarity NPD4310 Phase 3
0.6798 Remote Similarity NPD5487 Phase 1
0.6797 Remote Similarity NPD2408 Discontinued
0.6797 Remote Similarity NPD4520 Approved
0.6795 Remote Similarity NPD6481 Clinical (unspecified phase)
0.6794 Remote Similarity NPD6771 Discontinued
0.6791 Remote Similarity NPD2144 Approved
0.679 Remote Similarity NPD3960 Clinical (unspecified phase)
0.6787 Remote Similarity NPD3439 Approved
0.6787 Remote Similarity NPD3321 Discontinued
0.6786 Remote Similarity NPD7023 Clinical (unspecified phase)
0.6776 Remote Similarity NPD5322 Clinical (unspecified phase)
0.6773 Remote Similarity NPD8020 Approved
0.6773 Remote Similarity NPD8021 Approved
0.6773 Remote Similarity NPD7394 Phase 2
0.6771 Remote Similarity NPD5575 Clinical (unspecified phase)
0.6769 Remote Similarity NPD6987 Phase 1
0.6769 Remote Similarity NPD7393 Clinical (unspecified phase)
0.6767 Remote Similarity NPD8321 Discontinued

Structure

External Identifiers

PubChem CID   11496375
ChEMBL   CHEMBL459275
ZINC  

Physicochemical Properties

Molecular Weight:  464.10
ALogP:  -1.4839
MLogP:  3
XLogP:  1.992
# Rotatable Bonds:  4
Polar Surface Area:  139.27
# H-Bond Aceptor:  7
# H-Bond Donor:  3
# Rings:  5
# Heavy Atoms:  32

Download Data

Data Type Select
General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs