Natural Product: NPC472639

Natural Product ID:  NPC472639
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C40H52O8
Standard InCHIKey:  QQXFQHBKNHOYQL-UISDQWEOSA-N
Standard InCHI:  InChI=1S/C40H52O8/c1-19(2)23-9-24-26-10-27-35(5,6)12-21(41)14-37(27,17-45-26)30(24)33-32(23)47-39-16-25(20(3)4)31(43)34(44)40(39,48-33)38-15-22(42)13-36(7,8)28(38)11-29(39)46-18-38/h9,16,19-22,26-29,41-42H,10-15,17-18H2,1-8H3/t21-,22-,26?,27-,28-,29?,37?,38?,39-,40+/m0/s1
Canonical SMILES:  O[C@H]1CC(C)(C)[C@H]2C3(C1)COC(C2)[C@]12[C@@]3(Oc3c(O2)c(cc2c3C34COC2C[C@H]4C(C[C@@H](C3)O)(C)C)C(C)C)C(=O)C(=O)C(=C1)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
NPO1371 Teucrium viscidum Species Lamiaceae Eukaryota PMID[25739048]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified IC50 > 10000 nM 15711537
NPT2 Others Unspecified IC50 > 1000000 nM 25871540
NPT393 Cell Line HCT-116 Homo sapiens IC50 > 10000 nM 12161151
NPT165 Cell Line HeLa Homo sapiens IC50 > 10000 nM 19585998
NPT65 Cell Line HepG2 Homo sapiens IC50 > 10000 nM 18710917
NPT2 Others Unspecified IC50 > 10000 nM 18710917

  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 NPC472639 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
0.9876 High Similarity NPC472638
0.8547 High Similarity NPC265563
0.8547 High Similarity NPC304125
0.8448 Intermediate Similarity NPC469393
0.84 Intermediate Similarity NPC294149
0.8382 Intermediate Similarity NPC286074
0.8382 Intermediate Similarity NPC54903
0.8372 Intermediate Similarity NPC263212
0.8353 Intermediate Similarity NPC474239
0.8343 Intermediate Similarity NPC124828
0.8333 Intermediate Similarity NPC313717
0.8333 Intermediate Similarity NPC472803
0.8333 Intermediate Similarity NPC315306
0.8333 Intermediate Similarity NPC74559
0.8333 Intermediate Similarity NPC103307
0.8324 Intermediate Similarity NPC474024
0.8305 Intermediate Similarity NPC470334
0.8286 Intermediate Similarity NPC472620
0.8284 Intermediate Similarity NPC268602
0.8276 Intermediate Similarity NPC326877
0.8268 Intermediate Similarity NPC150977
0.8266 Intermediate Similarity NPC85047
0.8266 Intermediate Similarity NPC17274
0.8266 Intermediate Similarity NPC469394
0.8266 Intermediate Similarity NPC120857
0.8256 Intermediate Similarity NPC474240
0.8256 Intermediate Similarity NPC25889
0.8249 Intermediate Similarity NPC475054
0.8242 Intermediate Similarity NPC314672
0.8239 Intermediate Similarity NPC154986
0.8235 Intermediate Similarity NPC472617
0.8218 Intermediate Similarity NPC472622
0.8218 Intermediate Similarity NPC150131
0.8212 Intermediate Similarity NPC6709
0.8212 Intermediate Similarity NPC208069
0.8208 Intermediate Similarity NPC316262
0.8208 Intermediate Similarity NPC475888
0.8208 Intermediate Similarity NPC314653
0.8202 Intermediate Similarity NPC47191
0.8198 Intermediate Similarity NPC475144
0.8192 Intermediate Similarity NPC146803
0.8187 Intermediate Similarity NPC472618
0.8187 Intermediate Similarity NPC205721
0.8182 Intermediate Similarity NPC121333
0.8182 Intermediate Similarity NPC118128
0.8182 Intermediate Similarity NPC186847
0.8182 Intermediate Similarity NPC477529
0.8182 Intermediate Similarity NPC257667
0.8182 Intermediate Similarity NPC472454
0.8182 Intermediate Similarity NPC4200
0.8177 Intermediate Similarity NPC112380
0.8171 Intermediate Similarity NPC472619
0.8171 Intermediate Similarity NPC20734
0.8161 Intermediate Similarity NPC477517
0.8161 Intermediate Similarity NPC471213
0.8161 Intermediate Similarity NPC272502
0.8161 Intermediate Similarity NPC472621
0.8156 Intermediate Similarity NPC473729
0.8156 Intermediate Similarity NPC244903
0.8156 Intermediate Similarity NPC120102
0.8156 Intermediate Similarity NPC185275
0.8156 Intermediate Similarity NPC473607
0.8152 Intermediate Similarity NPC314459
0.8152 Intermediate Similarity NPC470199
0.815 Intermediate Similarity NPC469395
0.8146 Intermediate Similarity NPC98943
0.8146 Intermediate Similarity NPC478050
0.814 Intermediate Similarity NPC316457
0.8136 Intermediate Similarity NPC475080
0.8136 Intermediate Similarity NPC476311
0.8136 Intermediate Similarity NPC470336
0.8136 Intermediate Similarity NPC470335
0.8136 Intermediate Similarity NPC199357
0.8128 Intermediate Similarity NPC131405
0.8125 Intermediate Similarity NPC193698
0.8114 Intermediate Similarity NPC117854
0.8114 Intermediate Similarity NPC477154
0.8114 Intermediate Similarity NPC6588
0.8114 Intermediate Similarity NPC8965
0.8114 Intermediate Similarity NPC476306
0.8114 Intermediate Similarity NPC218226
0.8103 Intermediate Similarity NPC25361
0.8103 Intermediate Similarity NPC62261
0.8103 Intermediate Similarity NPC293319
0.8101 Intermediate Similarity NPC246877
0.8101 Intermediate Similarity NPC476199
0.8101 Intermediate Similarity NPC476210
0.8101 Intermediate Similarity NPC265380
0.8101 Intermediate Similarity NPC478000
0.8101 Intermediate Similarity NPC477682
0.8101 Intermediate Similarity NPC477683
0.8095 Intermediate Similarity NPC48671
0.8092 Intermediate Similarity NPC52204
0.8092 Intermediate Similarity NPC211107
0.809 Intermediate Similarity NPC245975
0.8081 Intermediate Similarity NPC299436
0.8081 Intermediate Similarity NPC472961
0.8081 Intermediate Similarity NPC472962
0.8079 Intermediate Similarity NPC135334
0.8079 Intermediate Similarity NPC469778
0.8079 Intermediate Similarity NPC169018
0.8079 Intermediate Similarity NPC295941
0.8079 Intermediate Similarity NPC32723
0.8079 Intermediate Similarity NPC100925
0.8079 Intermediate Similarity NPC469774
0.8079 Intermediate Similarity NPC469775
0.8079 Intermediate Similarity NPC476159
0.8079 Intermediate Similarity NPC469772
0.8079 Intermediate Similarity NPC469777
0.8079 Intermediate Similarity NPC469773
0.8079 Intermediate Similarity NPC469776
0.8077 Intermediate Similarity NPC197972
0.8077 Intermediate Similarity NPC96194
0.8077 Intermediate Similarity NPC299855
0.8068 Intermediate Similarity NPC41598
0.8068 Intermediate Similarity NPC300307
0.8068 Intermediate Similarity NPC152477
0.8068 Intermediate Similarity NPC242395
0.8068 Intermediate Similarity NPC177480
0.8068 Intermediate Similarity NPC216403
0.8068 Intermediate Similarity NPC41494
0.8068 Intermediate Similarity NPC217378
0.8068 Intermediate Similarity NPC186100
0.8068 Intermediate Similarity NPC188079
0.8066 Intermediate Similarity NPC475148
0.8066 Intermediate Similarity NPC313452
0.8066 Intermediate Similarity NPC473883
0.8066 Intermediate Similarity NPC475656
0.8066 Intermediate Similarity NPC478001
0.8065 Intermediate Similarity NPC470197
0.8065 Intermediate Similarity NPC470196
0.8065 Intermediate Similarity NPC282474
0.8065 Intermediate Similarity NPC470198
0.8065 Intermediate Similarity NPC470200
0.8065 Intermediate Similarity NPC470194
0.8065 Intermediate Similarity NPC470195
0.8065 Intermediate Similarity NPC316274
0.8065 Intermediate Similarity NPC470193
0.8059 Intermediate Similarity NPC478159
0.8059 Intermediate Similarity NPC478161
0.8057 Intermediate Similarity NPC475109
0.8057 Intermediate Similarity NPC178173
0.8057 Intermediate Similarity NPC173292
0.8057 Intermediate Similarity NPC120593
0.8057 Intermediate Similarity NPC128293
0.8057 Intermediate Similarity NPC472150
0.8057 Intermediate Similarity NPC476255
0.8057 Intermediate Similarity NPC43319
0.8056 Intermediate Similarity NPC212290
0.8046 Intermediate Similarity NPC173729
0.8046 Intermediate Similarity NPC223006
0.8046 Intermediate Similarity NPC134047
0.8046 Intermediate Similarity NPC272750
0.8046 Intermediate Similarity NPC197168
0.8046 Intermediate Similarity NPC290160
0.8045 Intermediate Similarity NPC289876
0.8045 Intermediate Similarity NPC46958
0.8043 Intermediate Similarity NPC71385
0.8043 Intermediate Similarity NPC230670
0.8043 Intermediate Similarity NPC201814
0.8035 Intermediate Similarity NPC474351
0.8035 Intermediate Similarity NPC471211
0.8035 Intermediate Similarity NPC134783
0.8035 Intermediate Similarity NPC475883
0.8035 Intermediate Similarity NPC478134
0.8035 Intermediate Similarity NPC165549
0.8035 Intermediate Similarity NPC103816
0.8035 Intermediate Similarity NPC61382
0.8035 Intermediate Similarity NPC471212
0.8035 Intermediate Similarity NPC474186
0.8034 Intermediate Similarity NPC471969
0.8034 Intermediate Similarity NPC476139
0.8034 Intermediate Similarity NPC470942
0.8033 Intermediate Similarity NPC189704
0.8024 Intermediate Similarity NPC474556
0.8023 Intermediate Similarity NPC473990
0.8023 Intermediate Similarity NPC102277
0.8023 Intermediate Similarity NPC279209
0.8023 Intermediate Similarity NPC52598
0.8021 Intermediate Similarity NPC3474
0.8011 Intermediate Similarity NPC105414
0.8011 Intermediate Similarity NPC225419
0.8011 Intermediate Similarity NPC470341
0.8011 Intermediate Similarity NPC470456
0.8011 Intermediate Similarity NPC315221
0.8011 Intermediate Similarity NPC472058
0.8011 Intermediate Similarity NPC223413
0.8011 Intermediate Similarity NPC193222
0.8011 Intermediate Similarity NPC234497
0.8011 Intermediate Similarity NPC260266
0.8011 Intermediate Similarity NPC158761
0.8011 Intermediate Similarity NPC314020
0.8011 Intermediate Similarity NPC324522
0.8011 Intermediate Similarity NPC469521
0.8 Intermediate Similarity NPC21016
0.8 Intermediate Similarity NPC7154
0.8 Intermediate Similarity NPC48474
0.8 Intermediate Similarity NPC470581
0.8 Intermediate Similarity NPC72787
0.8 Intermediate Similarity NPC36916

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC472639 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
0.8 Intermediate Similarity NPD6166 Phase 2
0.8 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7935 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7931 Intermediate Similarity NPD6959 Discontinued
0.7874 Intermediate Similarity NPD5494 Approved
0.7865 Intermediate Similarity NPD5844 Phase 1
0.7845 Intermediate Similarity NPD8313 Approved
0.7845 Intermediate Similarity NPD8312 Approved
0.7829 Intermediate Similarity NPD8127 Discontinued
0.7826 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7809 Intermediate Similarity NPD3751 Discontinued
0.779 Intermediate Similarity NPD7808 Phase 3
0.7784 Intermediate Similarity NPD3787 Discontinued
0.7778 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.776 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7753 Intermediate Similarity NPD7473 Discontinued
0.7722 Intermediate Similarity NPD7074 Phase 3
0.7688 Intermediate Similarity NPD7819 Suspended
0.7667 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7637 Intermediate Similarity NPD7251 Discontinued
0.7622 Intermediate Similarity NPD8434 Phase 2
0.7622 Intermediate Similarity NPD8150 Discontinued
0.7586 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7586 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7584 Intermediate Similarity NPD6232 Discontinued
0.7582 Intermediate Similarity NPD6797 Phase 2
0.7569 Intermediate Similarity NPD7054 Approved
0.7557 Intermediate Similarity NPD7075 Discontinued
0.7545 Intermediate Similarity NPD6674 Discontinued
0.7543 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7543 Intermediate Similarity NPD3817 Phase 2
0.7529 Intermediate Similarity NPD1934 Approved
0.7527 Intermediate Similarity NPD7472 Approved
0.7526 Intermediate Similarity NPD7696 Phase 3
0.7526 Intermediate Similarity NPD7697 Approved
0.7526 Intermediate Similarity NPD7698 Approved
0.7514 Intermediate Similarity NPD7228 Approved
0.75 Intermediate Similarity NPD3882 Suspended
0.75 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7487 Intermediate Similarity NPD7870 Phase 2
0.7487 Intermediate Similarity NPD7871 Phase 2
0.747 Intermediate Similarity NPD6100 Approved
0.747 Intermediate Similarity NPD6099 Approved
0.7436 Intermediate Similarity NPD7435 Discontinued
0.7429 Intermediate Similarity NPD37 Approved
0.7414 Intermediate Similarity NPD6599 Discontinued
0.7414 Intermediate Similarity NPD4380 Phase 2
0.7405 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7401 Intermediate Similarity NPD4966 Approved
0.7401 Intermediate Similarity NPD4965 Approved
0.7401 Intermediate Similarity NPD4967 Phase 2
0.7398 Intermediate Similarity NPD8319 Approved
0.7398 Intermediate Similarity NPD8320 Phase 1
0.7396 Intermediate Similarity NPD8166 Discontinued
0.7396 Intermediate Similarity NPD2975 Approved
0.7396 Intermediate Similarity NPD2974 Approved
0.7396 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7396 Intermediate Similarity NPD2973 Approved
0.7374 Intermediate Similarity NPD7701 Phase 2
0.7371 Intermediate Similarity NPD6778 Approved
0.7371 Intermediate Similarity NPD6776 Approved
0.7371 Intermediate Similarity NPD6781 Approved
0.7371 Intermediate Similarity NPD6777 Approved
0.7371 Intermediate Similarity NPD6782 Approved
0.7371 Intermediate Similarity NPD6780 Approved
0.7371 Intermediate Similarity NPD6779 Approved
0.7371 Intermediate Similarity NPD4580 Approved
0.7358 Intermediate Similarity NPD7700 Phase 2
0.7358 Intermediate Similarity NPD7699 Phase 2
0.7356 Intermediate Similarity NPD7458 Discontinued
0.7351 Intermediate Similarity NPD7240 Approved
0.7348 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD8151 Discontinued
0.733 Intermediate Similarity NPD6801 Discontinued
0.7322 Intermediate Similarity NPD3818 Discontinued
0.73 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.73 Intermediate Similarity NPD7874 Approved
0.7288 Intermediate Similarity NPD8455 Phase 2
0.7288 Intermediate Similarity NPD1465 Phase 2
0.7288 Intermediate Similarity NPD2801 Approved
0.7264 Intermediate Similarity NPD7801 Approved
0.7257 Intermediate Similarity NPD3226 Approved
0.7251 Intermediate Similarity NPD6190 Approved
0.7245 Intermediate Similarity NPD2494 Approved
0.7245 Intermediate Similarity NPD2493 Approved
0.7238 Intermediate Similarity NPD7199 Phase 2
0.7225 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD4582 Approved
0.7222 Intermediate Similarity NPD6234 Discontinued
0.7222 Intermediate Similarity NPD4583 Approved
0.7219 Intermediate Similarity NPD2346 Discontinued
0.7213 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD6534 Approved
0.7202 Intermediate Similarity NPD6535 Approved
0.7193 Intermediate Similarity NPD4628 Phase 3
0.7175 Intermediate Similarity NPD7411 Suspended
0.7172 Intermediate Similarity NPD4002 Approved
0.7172 Intermediate Similarity NPD4004 Approved
0.7167 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7157 Intermediate Similarity NPD3450 Approved
0.7157 Intermediate Similarity NPD3452 Approved
0.7151 Intermediate Similarity NPD5402 Approved
0.7143 Intermediate Similarity NPD1247 Approved
0.7126 Intermediate Similarity NPD2532 Approved
0.7126 Intermediate Similarity NPD2534 Approved
0.7126 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD2533 Approved
0.7115 Intermediate Similarity NPD7907 Approved
0.7094 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7094 Intermediate Similarity NPD7783 Phase 2
0.7093 Intermediate Similarity NPD7003 Approved
0.709 Intermediate Similarity NPD2968 Approved
0.709 Intermediate Similarity NPD2971 Approved
0.7086 Intermediate Similarity NPD1512 Approved
0.7086 Intermediate Similarity NPD6273 Approved
0.7074 Intermediate Similarity NPD6559 Discontinued
0.7069 Intermediate Similarity NPD7390 Discontinued
0.7069 Intermediate Similarity NPD6799 Approved
0.7065 Intermediate Similarity NPD3926 Phase 2
0.7062 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7048 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7047 Intermediate Similarity NPD2490 Approved
0.7047 Intermediate Similarity NPD2488 Approved
0.7043 Intermediate Similarity NPD7799 Discontinued
0.7041 Intermediate Similarity NPD7097 Phase 1
0.7035 Intermediate Similarity NPD6823 Phase 2
0.7035 Intermediate Similarity NPD2800 Approved
0.7033 Intermediate Similarity NPD919 Approved
0.7033 Intermediate Similarity NPD5537 Clinical (unspecified phase)
0.7033 Intermediate Similarity NPD8155 Clinical (unspecified phase)
0.7017 Intermediate Similarity NPD7768 Phase 2
0.7 Intermediate Similarity NPD5761 Phase 2
0.7 Intermediate Similarity NPD3534 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD5760 Phase 2
0.6984 Remote Similarity NPD7685 Pre-registration
0.6977 Remote Similarity NPD1549 Phase 2
0.6971 Remote Similarity NPD1511 Approved
0.697 Remote Similarity NPD8285 Discontinued
0.6967 Remote Similarity NPD5619 Clinical (unspecified phase)
0.6959 Remote Similarity NPD2796 Approved
0.695 Remote Similarity NPD3057 Approved
0.6949 Remote Similarity NPD5403 Approved
0.6938 Remote Similarity NPD4665 Approved
0.6938 Remote Similarity NPD4111 Phase 1
0.6936 Remote Similarity NPD5698 Clinical (unspecified phase)
0.6936 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6935 Remote Similarity NPD7501 Clinical (unspecified phase)
0.6932 Remote Similarity NPD5401 Approved
0.6927 Remote Similarity NPD7028 Phase 2
0.6923 Remote Similarity NPD6355 Discontinued
0.6919 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6919 Remote Similarity NPD7229 Phase 3
0.6919 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6919 Remote Similarity NPD5762 Approved
0.6919 Remote Similarity NPD5763 Approved
0.6914 Remote Similarity NPD7236 Approved
0.691 Remote Similarity NPD7239 Suspended
0.6897 Remote Similarity NPD4110 Phase 3
0.6897 Remote Similarity NPD7982 Clinical (unspecified phase)
0.6897 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6895 Remote Similarity NPD8368 Discontinued
0.6886 Remote Similarity NPD7095 Approved
0.6885 Remote Similarity NPD3749 Approved
0.6882 Remote Similarity NPD6651 Approved
0.6866 Remote Similarity NPD2972 Approved
0.6866 Remote Similarity NPD3533 Approved
0.6864 Remote Similarity NPD4060 Phase 1
0.6845 Remote Similarity NPD7985 Registered
0.6845 Remote Similarity NPD1699 Clinical (unspecified phase)
0.6845 Remote Similarity NPD5676 Approved
0.6845 Remote Similarity NPD6798 Discontinued
0.6821 Remote Similarity NPD8435 Approved
0.6806 Remote Similarity NPD6765 Approved
0.6806 Remote Similarity NPD6764 Approved
0.6805 Remote Similarity NPD8032 Phase 2
0.6802 Remote Similarity NPD1509 Clinical (unspecified phase)
0.6802 Remote Similarity NPD2799 Discontinued
0.68 Remote Similarity NPD7237 Clinical (unspecified phase)
0.68 Remote Similarity NPD3750 Approved
0.6788 Remote Similarity NPD8407 Phase 2
0.6788 Remote Similarity NPD8651 Approved
0.6784 Remote Similarity NPD8485 Approved
0.6784 Remote Similarity NPD8090 Clinical (unspecified phase)
0.6782 Remote Similarity NPD970 Clinical (unspecified phase)
0.6782 Remote Similarity NPD2424 Discontinued
0.678 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6766 Remote Similarity NPD4107 Approved
0.6765 Remote Similarity NPD1612 Clinical (unspecified phase)
0.6765 Remote Similarity NPD3620 Phase 2
0.6765 Remote Similarity NPD1613 Approved
0.6765 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6765 Remote Similarity NPD7211 Clinical (unspecified phase)
0.676 Remote Similarity NPD6980 Clinical (unspecified phase)
0.6749 Remote Similarity NPD7680 Approved
0.6746 Remote Similarity NPD4907 Clinical (unspecified phase)
0.6746 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6738 Remote Similarity NPD5711 Approved

Structure

External Identifiers

PubChem CID  
ChEMBL   CHEMBL3581363
ZINC  

Physicochemical Properties

Molecular Weight:  660.37
ALogP:  0.193
MLogP:  4.98
XLogP:  5.373
# Rotatable Bonds:  12
Polar Surface Area:  111.52
# H-Bond Aceptor:  6
# H-Bond Donor:  2
# Rings:  5
# Heavy Atoms:  48

Download Data

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