Natural Product: NPC223592

Natural Product ID:  NPC223592
Common Name:   Protosappanin A
IUPAC Name:  
Synonyms:  
Molecular Formula:   C15H12O5
Standard InCHIKey:  MUKYVRVYBBYJSI-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C15H12O5/c16-9-1-2-11-12-6-14(19)13(18)4-8(12)3-10(17)7-20-15(11)5-9/h1-2,4-6,16,18-19H,3,7H2
Canonical SMILES:  O=C1COc2cc(O)ccc2c2c(C1)cc(O)c(c2)O
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
NPO32846 heamatoxylon campechianum Species NA NA Stems XiShuangBanNa, Yunnan Province, China 2005-SEP PMID[18610999]
NPO29935 Caesalpinia sappan Species Fabaceae Eukaryota PMID[21800859]
NPO29935 Caesalpinia sappan Species Fabaceae Eukaryota heartwood PMID[23127886]
NPO12323 Bos taurus Species Bovidae Eukaryota HerDing*
NPO29935 Caesalpinia sappan Species Fabaceae Eukaryota TCM_Taiwan*
NPO29935 Caesalpinia sappan Species Fabaceae Eukaryota HerDing*
NPO29935 Caesalpinia sappan Species Fabaceae Eukaryota heartwood PMID[21800859]
NPO12323 Bos taurus Species Bovidae Eukaryota TCMID*
NPO17393 Bubalus bubalis Species Bovidae Eukaryota TCMID*
NPO7676 Caesalpinia japonica Species Fabaceae Eukaryota TCMID*
NPO2554 Biancaea sappan Species Fabaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT36 Individual Protein Tyrosine-protein kinase SRC Homo sapiens Inhibition = 0 % 18610999
NPT1478 Individual Protein Vascular endothelial growth factor receptor 2 Homo sapiens Inhibition = 3.6 % 18610999
NPT1479 Individual Protein Stem cell growth factor receptor Homo sapiens Inhibition = 0 % 18610999
NPT285 Individual Protein Epidermal growth factor receptor erbB1 Homo sapiens Inhibition = 0.9 % 18610999
NPT1480 Individual Protein Fibroblast growth factor receptor 1 Homo sapiens Inhibition = 29 % 18610999
NPT1481 Individual Protein Fibroblast growth factor receptor 2 Homo sapiens Inhibition = 0 % 18610999
NPT113 Cell Line RAW264.7 Mus musculus IC50 = 12500 nM 23127886

  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 NPC223592 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
0.9858 High Similarity NPC237904
0.932 High Similarity NPC28103
0.8882 High Similarity NPC153512
0.8816 High Similarity NPC80534
0.8816 High Similarity NPC56786
0.8725 High Similarity NPC140840
0.8725 High Similarity NPC86847
0.8693 High Similarity NPC67396
0.8684 High Similarity NPC260491
0.8684 High Similarity NPC36835
0.8684 High Similarity NPC9743
0.8684 High Similarity NPC61506
0.8684 High Similarity NPC246162
0.8684 High Similarity NPC240476
0.8675 High Similarity NPC188871
0.8675 High Similarity NPC149127
0.8675 High Similarity NPC286342
0.8667 High Similarity NPC19545
0.8667 High Similarity NPC321011
0.8667 High Similarity NPC3036
0.8667 High Similarity NPC294852
0.8667 High Similarity NPC188679
0.8658 High Similarity NPC20791
0.8658 High Similarity NPC179271
0.8649 High Similarity NPC474982
0.8636 High Similarity NPC24640
0.8636 High Similarity NPC471500
0.8627 High Similarity NPC325028
0.8627 High Similarity NPC256346
0.8627 High Similarity NPC27532
0.8627 High Similarity NPC246328
0.8627 High Similarity NPC141212
0.8618 High Similarity NPC260895
0.8609 High Similarity NPC1612
0.8609 High Similarity NPC183959
0.8609 High Similarity NPC105512
0.8609 High Similarity NPC270465
0.8609 High Similarity NPC87125
0.86 High Similarity NPC51443
0.86 High Similarity NPC74881
0.86 High Similarity NPC95864
0.8591 High Similarity NPC474799
0.8581 High Similarity NPC273843
0.8581 High Similarity NPC471479
0.8581 High Similarity NPC471515
0.8571 High Similarity NPC472335
0.8571 High Similarity NPC472332
0.8571 High Similarity NPC133392
0.8562 High Similarity NPC304954
0.8562 High Similarity NPC279989
0.8562 High Similarity NPC19721
0.8562 High Similarity NPC109240
0.8562 High Similarity NPC82325
0.8562 High Similarity NPC260979
0.8553 High Similarity NPC260582
0.8553 High Similarity NPC151473
0.8553 High Similarity NPC477517
0.8553 High Similarity NPC85131
0.8543 High Similarity NPC119059
0.8533 High Similarity NPC138978
0.8533 High Similarity NPC169749
0.8526 High Similarity NPC210459
0.8526 High Similarity NPC104876
0.8526 High Similarity NPC245891
0.8526 High Similarity NPC55738
0.8523 High Similarity NPC242893
0.8523 High Similarity NPC38065
0.8523 High Similarity NPC279121
0.8516 High Similarity NPC326037
0.8516 High Similarity NPC201837
0.8516 High Similarity NPC474638
0.8516 High Similarity NPC13779
0.8516 High Similarity NPC13858
0.8516 High Similarity NPC320825
0.8516 High Similarity NPC475799
0.8506 High Similarity NPC78326
0.8506 High Similarity NPC469550
0.8506 High Similarity NPC236223
0.8506 High Similarity NPC189130
0.8506 High Similarity NPC179126
0.8506 High Similarity NPC270620
0.8503 High Similarity NPC19158
0.8497 Intermediate Similarity NPC125062
0.8497 Intermediate Similarity NPC272566
0.8497 Intermediate Similarity NPC54394
0.8497 Intermediate Similarity NPC252933
0.8497 Intermediate Similarity NPC200740
0.8497 Intermediate Similarity NPC204350
0.8497 Intermediate Similarity NPC204515
0.8497 Intermediate Similarity NPC78505
0.8497 Intermediate Similarity NPC202157
0.8487 Intermediate Similarity NPC195351
0.8481 Intermediate Similarity NPC211107
0.8477 Intermediate Similarity NPC108406
0.8471 Intermediate Similarity NPC470183
0.8471 Intermediate Similarity NPC321399
0.8471 Intermediate Similarity NPC474960
0.8471 Intermediate Similarity NPC471744
0.8471 Intermediate Similarity NPC36217
0.8467 Intermediate Similarity NPC70136
0.8462 Intermediate Similarity NPC472963
0.8462 Intermediate Similarity NPC111969
0.8462 Intermediate Similarity NPC52530
0.8462 Intermediate Similarity NPC67876
0.8456 Intermediate Similarity NPC287722
0.8456 Intermediate Similarity NPC175013
0.8452 Intermediate Similarity NPC214138
0.8452 Intermediate Similarity NPC20541
0.8446 Intermediate Similarity NPC110419
0.8442 Intermediate Similarity NPC302950
0.8442 Intermediate Similarity NPC37684
0.8442 Intermediate Similarity NPC472912
0.8442 Intermediate Similarity NPC236637
0.8442 Intermediate Similarity NPC219582
0.8442 Intermediate Similarity NPC123886
0.8442 Intermediate Similarity NPC157784
0.8442 Intermediate Similarity NPC55205
0.8442 Intermediate Similarity NPC63187
0.8431 Intermediate Similarity NPC29231
0.8431 Intermediate Similarity NPC62042
0.8431 Intermediate Similarity NPC77858
0.8428 Intermediate Similarity NPC1755
0.8428 Intermediate Similarity NPC39305
0.8428 Intermediate Similarity NPC263092
0.8428 Intermediate Similarity NPC59295
0.8428 Intermediate Similarity NPC1706
0.8421 Intermediate Similarity NPC196277
0.8421 Intermediate Similarity NPC272721
0.8421 Intermediate Similarity NPC276930
0.8421 Intermediate Similarity NPC43669
0.8421 Intermediate Similarity NPC218569
0.8418 Intermediate Similarity NPC112418
0.8418 Intermediate Similarity NPC173137
0.8411 Intermediate Similarity NPC208507
0.8411 Intermediate Similarity NPC472333
0.8408 Intermediate Similarity NPC22192
0.8408 Intermediate Similarity NPC280680
0.8408 Intermediate Similarity NPC85121
0.8408 Intermediate Similarity NPC329091
0.84 Intermediate Similarity NPC105213
0.84 Intermediate Similarity NPC207732
0.8397 Intermediate Similarity NPC245546
0.8397 Intermediate Similarity NPC472907
0.8397 Intermediate Similarity NPC43243
0.8397 Intermediate Similarity NPC3980
0.8397 Intermediate Similarity NPC250922
0.8397 Intermediate Similarity NPC266960
0.8397 Intermediate Similarity NPC472461
0.8397 Intermediate Similarity NPC265511
0.8397 Intermediate Similarity NPC469474
0.8389 Intermediate Similarity NPC284556
0.8389 Intermediate Similarity NPC312256
0.8389 Intermediate Similarity NPC301178
0.8387 Intermediate Similarity NPC125487
0.8387 Intermediate Similarity NPC89474
0.8387 Intermediate Similarity NPC18727
0.8387 Intermediate Similarity NPC162351
0.8387 Intermediate Similarity NPC192083
0.8387 Intermediate Similarity NPC281703
0.8387 Intermediate Similarity NPC58382
0.8387 Intermediate Similarity NPC213896
0.8387 Intermediate Similarity NPC472905
0.8377 Intermediate Similarity NPC59162
0.8377 Intermediate Similarity NPC225731
0.8377 Intermediate Similarity NPC31363
0.8377 Intermediate Similarity NPC236769
0.8377 Intermediate Similarity NPC304295
0.8377 Intermediate Similarity NPC205046
0.8377 Intermediate Similarity NPC28274
0.8377 Intermediate Similarity NPC133953
0.8377 Intermediate Similarity NPC230848
0.8377 Intermediate Similarity NPC50403
0.8375 Intermediate Similarity NPC475888
0.8366 Intermediate Similarity NPC223579
0.8366 Intermediate Similarity NPC287101
0.8366 Intermediate Similarity NPC52005
0.8366 Intermediate Similarity NPC137062
0.8366 Intermediate Similarity NPC183950
0.8366 Intermediate Similarity NPC159103
0.8365 Intermediate Similarity NPC272722
0.8365 Intermediate Similarity NPC201800
0.8365 Intermediate Similarity NPC471745
0.8365 Intermediate Similarity NPC238995
0.8365 Intermediate Similarity NPC472964
0.8356 Intermediate Similarity NPC471182
0.8356 Intermediate Similarity NPC234952
0.8355 Intermediate Similarity NPC125449
0.8355 Intermediate Similarity NPC275772
0.8355 Intermediate Similarity NPC239312
0.8355 Intermediate Similarity NPC168803
0.8355 Intermediate Similarity NPC77598
0.8355 Intermediate Similarity NPC188074
0.8355 Intermediate Similarity NPC77378
0.8355 Intermediate Similarity NPC259632
0.8355 Intermediate Similarity NPC130230
0.8355 Intermediate Similarity NPC21835
0.8354 Intermediate Similarity NPC287328
0.8354 Intermediate Similarity NPC472902
0.8354 Intermediate Similarity NPC282009
0.8354 Intermediate Similarity NPC263449

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC223592 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
0.8658 High Similarity NPD1512 Approved
0.8523 High Similarity NPD1511 Approved
0.8516 High Similarity NPD3882 Suspended
0.8442 Intermediate Similarity NPD1934 Approved
0.8387 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8207 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.8207 Intermediate Similarity NPD1613 Approved
0.8182 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.8153 Intermediate Similarity NPD2801 Approved
0.8153 Intermediate Similarity NPD1465 Phase 2
0.8148 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.8148 Intermediate Similarity NPD6166 Phase 2
0.8148 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8121 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.8121 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.8112 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.8101 Intermediate Similarity NPD3817 Phase 2
0.8086 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.8067 Intermediate Similarity NPD1549 Phase 2
0.805 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7987 Intermediate Similarity NPD1510 Phase 2
0.7987 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7961 Intermediate Similarity NPD3750 Approved
0.7945 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7922 Intermediate Similarity NPD6799 Approved
0.7904 Intermediate Similarity NPD6797 Phase 2
0.7888 Intermediate Similarity NPD7075 Discontinued
0.7857 Intermediate Similarity NPD7251 Discontinued
0.7853 Intermediate Similarity NPD7199 Phase 2
0.7848 Intermediate Similarity NPD6599 Discontinued
0.7838 Intermediate Similarity NPD1240 Approved
0.7838 Intermediate Similarity NPD943 Approved
0.7831 Intermediate Similarity NPD3818 Discontinued
0.7829 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7817 Intermediate Similarity NPD1610 Phase 2
0.7815 Intermediate Similarity NPD6100 Approved
0.7815 Intermediate Similarity NPD6099 Approved
0.7812 Intermediate Similarity NPD7819 Suspended
0.7812 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7811 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7805 Intermediate Similarity NPD3787 Discontinued
0.7798 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD5844 Phase 1
0.7755 Intermediate Similarity NPD3027 Phase 3
0.7748 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7738 Intermediate Similarity NPD7074 Phase 3
0.7733 Intermediate Similarity NPD1607 Approved
0.773 Intermediate Similarity NPD919 Approved
0.7725 Intermediate Similarity NPD3751 Discontinued
0.7718 Intermediate Similarity NPD4060 Phase 1
0.7706 Intermediate Similarity NPD7808 Phase 3
0.7697 Intermediate Similarity NPD6232 Discontinued
0.7679 Intermediate Similarity NPD7054 Approved
0.7667 Intermediate Similarity NPD230 Phase 1
0.7665 Intermediate Similarity NPD7473 Discontinued
0.766 Intermediate Similarity NPD1548 Phase 1
0.764 Intermediate Similarity NPD6801 Discontinued
0.7639 Intermediate Similarity NPD1608 Approved
0.7636 Intermediate Similarity NPD1247 Approved
0.7636 Intermediate Similarity NPD6959 Discontinued
0.7633 Intermediate Similarity NPD7472 Approved
0.7632 Intermediate Similarity NPD3748 Approved
0.7625 Intermediate Similarity NPD4380 Phase 2
0.7622 Intermediate Similarity NPD6234 Discontinued
0.7582 Intermediate Similarity NPD2796 Approved
0.7568 Intermediate Similarity NPD4908 Phase 1
0.7561 Intermediate Similarity NPD3749 Approved
0.7561 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.755 Intermediate Similarity NPD6355 Discontinued
0.7546 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7545 Intermediate Similarity NPD3926 Phase 2
0.7532 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7517 Intermediate Similarity NPD4625 Phase 3
0.7471 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.747 Intermediate Similarity NPD5494 Approved
0.7468 Intermediate Similarity NPD1551 Phase 2
0.7467 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7467 Intermediate Similarity NPD6798 Discontinued
0.7452 Intermediate Similarity NPD6190 Approved
0.7439 Intermediate Similarity NPD5402 Approved
0.7438 Intermediate Similarity NPD5403 Approved
0.7431 Intermediate Similarity NPD17 Approved
0.7423 Intermediate Similarity NPD37 Approved
0.7421 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7421 Intermediate Similarity NPD5401 Approved
0.7394 Intermediate Similarity NPD4966 Approved
0.7394 Intermediate Similarity NPD4965 Approved
0.7394 Intermediate Similarity NPD4967 Phase 2
0.7389 Intermediate Similarity NPD4628 Phase 3
0.7381 Intermediate Similarity NPD7229 Phase 3
0.7362 Intermediate Similarity NPD7411 Suspended
0.7325 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7312 Intermediate Similarity NPD2534 Approved
0.7312 Intermediate Similarity NPD2533 Approved
0.7312 Intermediate Similarity NPD2532 Approved
0.731 Intermediate Similarity NPD7228 Approved
0.7297 Intermediate Similarity NPD1283 Approved
0.7294 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7289 Intermediate Similarity NPD7768 Phase 2
0.7273 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD9494 Approved
0.725 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7241 Intermediate Similarity NPD1651 Approved
0.723 Intermediate Similarity NPD4379 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7215 Intermediate Similarity NPD2800 Approved
0.7211 Intermediate Similarity NPD422 Phase 1
0.7197 Intermediate Similarity NPD2344 Approved
0.719 Intermediate Similarity NPD6233 Phase 2
0.7188 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7179 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7178 Intermediate Similarity NPD1653 Approved
0.7171 Intermediate Similarity NPD7095 Approved
0.717 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7152 Intermediate Similarity NPD2861 Phase 2
0.7143 Intermediate Similarity NPD6559 Discontinued
0.7124 Intermediate Similarity NPD3268 Approved
0.7117 Intermediate Similarity NPD920 Approved
0.7114 Intermediate Similarity NPD4749 Approved
0.7107 Intermediate Similarity NPD1243 Approved
0.7099 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7095 Intermediate Similarity NPD1281 Approved
0.7089 Intermediate Similarity NPD5762 Approved
0.7089 Intermediate Similarity NPD5763 Approved
0.7078 Intermediate Similarity NPD4062 Phase 3
0.707 Intermediate Similarity NPD7033 Discontinued
0.7055 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7047 Intermediate Similarity NPD1481 Phase 2
0.7047 Intermediate Similarity NPD9269 Phase 2
0.7043 Intermediate Similarity NPD2494 Approved
0.7043 Intermediate Similarity NPD3452 Approved
0.7043 Intermediate Similarity NPD3450 Approved
0.7043 Intermediate Similarity NPD2493 Approved
0.7042 Intermediate Similarity NPD228 Approved
0.7039 Intermediate Similarity NPD3018 Phase 2
0.703 Intermediate Similarity NPD3226 Approved
0.703 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7025 Intermediate Similarity NPD2935 Discontinued
0.7025 Intermediate Similarity NPD4476 Approved
0.7025 Intermediate Similarity NPD4477 Approved
0.7024 Intermediate Similarity NPD4288 Approved
0.702 Intermediate Similarity NPD2797 Approved
0.702 Intermediate Similarity NPD1203 Approved
0.7019 Intermediate Similarity NPD2309 Approved
0.7017 Intermediate Similarity NPD2490 Approved
0.7017 Intermediate Similarity NPD2488 Approved
0.7013 Intermediate Similarity NPD1296 Phase 2
0.7013 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.6994 Remote Similarity NPD3688 Clinical (unspecified phase)
0.6994 Remote Similarity NPD3146 Approved
0.6989 Remote Similarity NPD7501 Clinical (unspecified phase)
0.6987 Remote Similarity NPD447 Suspended
0.6981 Remote Similarity NPD1471 Phase 3
0.698 Remote Similarity NPD1535 Discovery
0.6978 Remote Similarity NPD7879 Clinical (unspecified phase)
0.6968 Remote Similarity NPD4002 Approved
0.6968 Remote Similarity NPD4004 Approved
0.6964 Remote Similarity NPD8455 Phase 2
0.6961 Remote Similarity NPD8397 Clinical (unspecified phase)
0.6959 Remote Similarity NPD1778 Approved
0.6957 Remote Similarity NPD3892 Phase 2
0.6957 Remote Similarity NPD4110 Phase 3
0.6957 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6957 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6954 Remote Similarity NPD3225 Approved
0.6946 Remote Similarity NPD7615 Clinical (unspecified phase)
0.6944 Remote Similarity NPD1241 Discontinued
0.6939 Remote Similarity NPD1894 Discontinued
0.6937 Remote Similarity NPD5958 Discontinued
0.6937 Remote Similarity NPD2897 Discontinued
0.6937 Remote Similarity NPD4534 Discontinued
0.6933 Remote Similarity NPD7390 Discontinued
0.6931 Remote Similarity NPD4583 Approved
0.6931 Remote Similarity NPD4582 Approved
0.6927 Remote Similarity NPD7090 Clinical (unspecified phase)
0.6923 Remote Similarity NPD2979 Phase 3
0.6923 Remote Similarity NPD1558 Phase 1
0.6918 Remote Similarity NPD1501 Clinical (unspecified phase)
0.6918 Remote Similarity NPD2438 Suspended
0.6914 Remote Similarity NPD2354 Approved
0.691 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6908 Remote Similarity NPD3266 Approved
0.6908 Remote Similarity NPD3267 Approved
0.6903 Remote Similarity NPD3764 Approved
0.6893 Remote Similarity NPD5953 Discontinued
0.6887 Remote Similarity NPD2982 Phase 2
0.6887 Remote Similarity NPD2983 Phase 2
0.6887 Remote Similarity NPD3600 Clinical (unspecified phase)
0.6875 Remote Similarity NPD2346 Discontinued
0.6875 Remote Similarity NPD2029 Clinical (unspecified phase)
0.6867 Remote Similarity NPD1547 Clinical (unspecified phase)
0.6867 Remote Similarity NPD1201 Approved
0.6863 Remote Similarity NPD6917 Clinical (unspecified phase)
0.6855 Remote Similarity NPD2799 Discontinued
0.6854 Remote Similarity NPD7240 Approved
0.6852 Remote Similarity NPD8166 Discontinued
0.6851 Remote Similarity NPD8434 Phase 2
0.6845 Remote Similarity NPD5090 Approved
0.6845 Remote Similarity NPD5089 Approved

Structure

External Identifiers

PubChem CID   128001
ChEMBL   CHEMBL447427
ZINC  

Physicochemical Properties

Molecular Weight:  272.07
ALogP:  -1.9658
MLogP:  2.56
XLogP:  0.812
# Rotatable Bonds:  3
Polar Surface Area:  86.99
# H-Bond Aceptor:  1
# H-Bond Donor:  3
# Rings:  3
# Heavy Atoms:  20

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Similar NPs/Drugs