Natural Product: NPC472151

Natural Product ID:  NPC472151
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C20H14O5
Standard InCHIKey:  QXONVTMVYZPQIX-QGZVFWFLSA-N
Standard InCHI:  InChI=1S/C20H14O5/c21-13-8-9-14(22)19-12(13)7-10-17(23)20(19)24-15-5-1-3-11-4-2-6-16(25-20)18(11)15/h1-10,17,21-23H/t17-/m1/s1
Canonical SMILES:  O[C@@H]1C=Cc2c(C31Oc1cccc4c1c(O3)ccc4)c(O)ccc2O
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
NPO33512 berkleasmium sp. Species NA Eukaryota PMID[25237727]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2921 Organism Pseudomonas Pseudomonas MIC = 25 ug/ml 22939698
NPT81 Cell Line A549 Homo sapiens IC50 > 10000 nM 9873488
NPT2 Others Unspecified IC50 > 10000 nM 19674905
NPT826 Organism Magnaporthe oryzae Magnaporthe oryzae IC50 = 35.9 ug/ml 18053715
NPT2 Others Unspecified IC50 > 10000 nM 19410459
NPT141 Organism Agrobacterium tumefaciens Agrobacterium tumefaciens MIC = 37.5 ug/ml 24345446
NPT179 Cell Line A2780 Homo sapiens IC50 > 10000 nM 18183025
NPT2 Others Unspecified IC50 > 10000 nM 23675610
NPT1477 Organism Staphylococcus haemolyticus Staphylococcus haemolyticus MIC = 37.5 ug/ml 19072209
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 50 ug/ml 22194678
NPT331 Organism Ralstonia solanacearum Ralstonia solanacearum MIC = 37.5 ug/ml 6481359
NPT4150 Organism Xanthomonas vesicatoria Xanthomonas vesicatoria MIC = 37.5 ug/ml 22925447

  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 NPC472151 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
0.942 High Similarity NPC271076
0.9348 High Similarity NPC151704
0.9338 High Similarity NPC193920
0.9323 High Similarity NPC138940
0.9143 High Similarity NPC472154
0.9078 High Similarity NPC288531
0.903 High Similarity NPC284232
0.9007 High Similarity NPC23807
0.8936 High Similarity NPC472155
0.8873 High Similarity NPC173630
0.8705 High Similarity NPC92932
0.8603 High Similarity NPC97326
0.8581 High Similarity NPC233467
0.8571 High Similarity NPC475628
0.8529 High Similarity NPC40377
0.8523 High Similarity NPC78809
0.8511 High Similarity NPC134260
0.8497 Intermediate Similarity NPC73148
0.8472 Intermediate Similarity NPC197461
0.8467 Intermediate Similarity NPC218003
0.8456 Intermediate Similarity NPC21902
0.8435 Intermediate Similarity NPC175976
0.8431 Intermediate Similarity NPC100936
0.8431 Intermediate Similarity NPC1253
0.8425 Intermediate Similarity NPC248053
0.8425 Intermediate Similarity NPC155564
0.8425 Intermediate Similarity NPC102280
0.8369 Intermediate Similarity NPC79957
0.8366 Intermediate Similarity NPC193749
0.8366 Intermediate Similarity NPC472156
0.8356 Intermediate Similarity NPC138915
0.8345 Intermediate Similarity NPC121376
0.8345 Intermediate Similarity NPC472451
0.8345 Intermediate Similarity NPC133585
0.8345 Intermediate Similarity NPC252169
0.8333 Intermediate Similarity NPC322899
0.8333 Intermediate Similarity NPC44192
0.8333 Intermediate Similarity NPC469944
0.8333 Intermediate Similarity NPC178054
0.8333 Intermediate Similarity NPC46283
0.8333 Intermediate Similarity NPC59692
0.8333 Intermediate Similarity NPC474442
0.8333 Intermediate Similarity NPC210192
0.8333 Intermediate Similarity NPC226108
0.8333 Intermediate Similarity NPC272552
0.8333 Intermediate Similarity NPC134911
0.8299 Intermediate Similarity NPC97662
0.8299 Intermediate Similarity NPC99515
0.8299 Intermediate Similarity NPC190714
0.8298 Intermediate Similarity NPC188555
0.8298 Intermediate Similarity NPC130496
0.8288 Intermediate Similarity NPC138227
0.8288 Intermediate Similarity NPC469313
0.8288 Intermediate Similarity NPC168579
0.8288 Intermediate Similarity NPC257404
0.8288 Intermediate Similarity NPC76176
0.8286 Intermediate Similarity NPC303422
0.8286 Intermediate Similarity NPC26080
0.8286 Intermediate Similarity NPC85799
0.8286 Intermediate Similarity NPC165686
0.8278 Intermediate Similarity NPC20050
0.8278 Intermediate Similarity NPC306267
0.8276 Intermediate Similarity NPC145319
0.8276 Intermediate Similarity NPC472353
0.8252 Intermediate Similarity NPC87777
0.8252 Intermediate Similarity NPC262328
0.8247 Intermediate Similarity NPC183402
0.8243 Intermediate Similarity NPC227902
0.8243 Intermediate Similarity NPC473480
0.8243 Intermediate Similarity NPC15538
0.8239 Intermediate Similarity NPC238243
0.8231 Intermediate Similarity NPC178014
0.8231 Intermediate Similarity NPC42716
0.8231 Intermediate Similarity NPC474749
0.8231 Intermediate Similarity NPC11422
0.8227 Intermediate Similarity NPC115022
0.8227 Intermediate Similarity NPC294166
0.8219 Intermediate Similarity NPC37793
0.8219 Intermediate Similarity NPC473044
0.8214 Intermediate Similarity NPC475067
0.8209 Intermediate Similarity NPC473875
0.8207 Intermediate Similarity NPC277331
0.8207 Intermediate Similarity NPC471389
0.8207 Intermediate Similarity NPC100482
0.8194 Intermediate Similarity NPC292487
0.8194 Intermediate Similarity NPC471388
0.8194 Intermediate Similarity NPC183781
0.8188 Intermediate Similarity NPC280945
0.8188 Intermediate Similarity NPC301961
0.8188 Intermediate Similarity NPC166584
0.8182 Intermediate Similarity NPC234952
0.8182 Intermediate Similarity NPC197723
0.8182 Intermediate Similarity NPC138350
0.8182 Intermediate Similarity NPC40664
0.8182 Intermediate Similarity NPC165482
0.8182 Intermediate Similarity NPC3293
0.8182 Intermediate Similarity NPC104167
0.8176 Intermediate Similarity NPC226540
0.8176 Intermediate Similarity NPC125755
0.8176 Intermediate Similarity NPC162193
0.8176 Intermediate Similarity NPC215678
0.8176 Intermediate Similarity NPC274454
0.8175 Intermediate Similarity NPC278552
0.8175 Intermediate Similarity NPC207179
0.8175 Intermediate Similarity NPC167571
0.8169 Intermediate Similarity NPC87696
0.8168 Intermediate Similarity NPC301321
0.8163 Intermediate Similarity NPC171932
0.8163 Intermediate Similarity NPC28440
0.8163 Intermediate Similarity NPC25292
0.8163 Intermediate Similarity NPC473045
0.8163 Intermediate Similarity NPC50250
0.8156 Intermediate Similarity NPC219876
0.8156 Intermediate Similarity NPC15658
0.8156 Intermediate Similarity NPC185604
0.8156 Intermediate Similarity NPC78770
0.8156 Intermediate Similarity NPC61477
0.8156 Intermediate Similarity NPC261619
0.8156 Intermediate Similarity NPC126029
0.8151 Intermediate Similarity NPC475084
0.8151 Intermediate Similarity NPC186033
0.8151 Intermediate Similarity NPC60249
0.8148 Intermediate Similarity NPC226712
0.8146 Intermediate Similarity NPC259707
0.8146 Intermediate Similarity NPC93619
0.8146 Intermediate Similarity NPC475890
0.8146 Intermediate Similarity NPC471403
0.8143 Intermediate Similarity NPC262606
0.8141 Intermediate Similarity NPC48880
0.8138 Intermediate Similarity NPC213607
0.8138 Intermediate Similarity NPC182509
0.8138 Intermediate Similarity NPC174787
0.8138 Intermediate Similarity NPC109240
0.8133 Intermediate Similarity NPC476969
0.8133 Intermediate Similarity NPC318373
0.8133 Intermediate Similarity NPC44452
0.8133 Intermediate Similarity NPC321657
0.8129 Intermediate Similarity NPC148366
0.8129 Intermediate Similarity NPC311293
0.8125 Intermediate Similarity NPC107551
0.8125 Intermediate Similarity NPC103976
0.8125 Intermediate Similarity NPC326797
0.8125 Intermediate Similarity NPC474282
0.8125 Intermediate Similarity NPC176051
0.8125 Intermediate Similarity NPC102904
0.8121 Intermediate Similarity NPC174251
0.8121 Intermediate Similarity NPC206579
0.8121 Intermediate Similarity NPC294558
0.8121 Intermediate Similarity NPC82917
0.8121 Intermediate Similarity NPC204770
0.8121 Intermediate Similarity NPC262911
0.8121 Intermediate Similarity NPC170103
0.8121 Intermediate Similarity NPC70409
0.8121 Intermediate Similarity NPC301949
0.8121 Intermediate Similarity NPC236202
0.8121 Intermediate Similarity NPC153182
0.8121 Intermediate Similarity NPC108811
0.8121 Intermediate Similarity NPC202742
0.8121 Intermediate Similarity NPC11800
0.8121 Intermediate Similarity NPC263940
0.8121 Intermediate Similarity NPC18185
0.8121 Intermediate Similarity NPC58190
0.8112 Intermediate Similarity NPC472337
0.8112 Intermediate Similarity NPC11727
0.8112 Intermediate Similarity NPC15109
0.8112 Intermediate Similarity NPC164787
0.8112 Intermediate Similarity NPC61946
0.8108 Intermediate Similarity NPC277867
0.8108 Intermediate Similarity NPC475096
0.8108 Intermediate Similarity NPC307466
0.8108 Intermediate Similarity NPC161700
0.8099 Intermediate Similarity NPC215037
0.8095 Intermediate Similarity NPC173203
0.8095 Intermediate Similarity NPC81638
0.8095 Intermediate Similarity NPC163508
0.8085 Intermediate Similarity NPC220825
0.8085 Intermediate Similarity NPC268342
0.8085 Intermediate Similarity NPC268266
0.8085 Intermediate Similarity NPC166168
0.8085 Intermediate Similarity NPC42760
0.8085 Intermediate Similarity NPC103799
0.8082 Intermediate Similarity NPC469661
0.8082 Intermediate Similarity NPC76871
0.8082 Intermediate Similarity NPC89686
0.8082 Intermediate Similarity NPC108674
0.8082 Intermediate Similarity NPC257095
0.8082 Intermediate Similarity NPC273932
0.8079 Intermediate Similarity NPC145979
0.8079 Intermediate Similarity NPC182368
0.8079 Intermediate Similarity NPC469706
0.8079 Intermediate Similarity NPC225815
0.8079 Intermediate Similarity NPC469707
0.8079 Intermediate Similarity NPC185955
0.8079 Intermediate Similarity NPC260781
0.8079 Intermediate Similarity NPC9933
0.8079 Intermediate Similarity NPC214326
0.8079 Intermediate Similarity NPC218041
0.8079 Intermediate Similarity NPC238140
0.8069 Intermediate Similarity NPC245207
0.8069 Intermediate Similarity NPC22517

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC472151 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
0.8156 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.8156 Intermediate Similarity NPD1613 Approved
0.8148 Intermediate Similarity NPD1091 Approved
0.8 Intermediate Similarity NPD3751 Discontinued
0.8 Intermediate Similarity NPD4908 Phase 1
0.7975 Intermediate Similarity NPD3787 Discontinued
0.7929 Intermediate Similarity NPD2861 Phase 2
0.7887 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7872 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7817 Intermediate Similarity NPD4625 Phase 3
0.7801 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7754 Intermediate Similarity NPD1610 Phase 2
0.7718 Intermediate Similarity NPD6674 Discontinued
0.7662 Intermediate Similarity NPD1653 Approved
0.7643 Intermediate Similarity NPD8455 Phase 2
0.76 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7591 Intermediate Similarity NPD1548 Phase 1
0.7582 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7569 Intermediate Similarity NPD3027 Phase 3
0.7534 Intermediate Similarity NPD4060 Phase 1
0.7518 Intermediate Similarity NPD4749 Approved
0.7517 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7515 Intermediate Similarity NPD5844 Phase 1
0.75 Intermediate Similarity NPD6671 Approved
0.7481 Intermediate Similarity NPD968 Approved
0.7424 Intermediate Similarity NPD290 Approved
0.7396 Intermediate Similarity NPD8313 Approved
0.7396 Intermediate Similarity NPD8312 Approved
0.7391 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7389 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7362 Intermediate Similarity NPD7199 Phase 2
0.7351 Intermediate Similarity NPD5763 Approved
0.7351 Intermediate Similarity NPD5762 Approved
0.7349 Intermediate Similarity NPD7228 Approved
0.7347 Intermediate Similarity NPD6233 Phase 2
0.7329 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7305 Intermediate Similarity NPD7054 Approved
0.7267 Intermediate Similarity NPD5402 Approved
0.7262 Intermediate Similarity NPD7074 Phase 3
0.7262 Intermediate Similarity NPD7472 Approved
0.7254 Intermediate Similarity NPD1611 Approved
0.725 Intermediate Similarity NPD37 Approved
0.7246 Intermediate Similarity NPD709 Approved
0.7239 Intermediate Similarity NPD6234 Discontinued
0.7237 Intermediate Similarity NPD7266 Discontinued
0.7235 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7234 Intermediate Similarity NPD5126 Approved
0.7234 Intermediate Similarity NPD5125 Phase 3
0.7229 Intermediate Similarity NPD6166 Phase 2
0.7229 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7229 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7226 Intermediate Similarity NPD5058 Phase 3
0.7222 Intermediate Similarity NPD4966 Approved
0.7222 Intermediate Similarity NPD4967 Phase 2
0.7222 Intermediate Similarity NPD4965 Approved
0.7219 Intermediate Similarity NPD6797 Phase 2
0.7208 Intermediate Similarity NPD3750 Approved
0.7183 Intermediate Similarity NPD3496 Discontinued
0.7179 Intermediate Similarity NPD7213 Phase 3
0.7179 Intermediate Similarity NPD7212 Phase 2
0.7176 Intermediate Similarity NPD7251 Discontinued
0.7176 Intermediate Similarity NPD6559 Discontinued
0.7169 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7162 Intermediate Similarity NPD6798 Discontinued
0.7161 Intermediate Similarity NPD2677 Approved
0.7152 Intermediate Similarity NPD4536 Approved
0.7152 Intermediate Similarity NPD6959 Discontinued
0.7152 Intermediate Similarity NPD4538 Approved
0.7152 Intermediate Similarity NPD4537 Clinical (unspecified phase)
0.7152 Intermediate Similarity NPD7097 Phase 1
0.7143 Intermediate Similarity NPD1934 Approved
0.7135 Intermediate Similarity NPD7808 Phase 3
0.7134 Intermediate Similarity NPD7447 Phase 1
0.7134 Intermediate Similarity NPD7446 Clinical (unspecified phase)
0.7133 Intermediate Similarity NPD5735 Approved
0.7133 Intermediate Similarity NPD3705 Approved
0.7123 Intermediate Similarity NPD6917 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD6516 Phase 2
0.7113 Intermediate Similarity NPD5846 Approved
0.7105 Intermediate Similarity NPD2156 Approved
0.7105 Intermediate Similarity NPD5960 Phase 3
0.7105 Intermediate Similarity NPD2154 Approved
0.7105 Intermediate Similarity NPD5588 Approved
0.7105 Intermediate Similarity NPD2155 Approved
0.7103 Intermediate Similarity NPD8651 Approved
0.7103 Intermediate Similarity NPD6696 Suspended
0.7102 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7097 Intermediate Similarity NPD3892 Phase 2
0.7086 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7041 Intermediate Similarity NPD3818 Discontinued
0.7034 Intermediate Similarity NPD3600 Clinical (unspecified phase)
0.7032 Intermediate Similarity NPD1652 Phase 2
0.7019 Intermediate Similarity NPD4380 Phase 2
0.7018 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7007 Intermediate Similarity NPD6584 Phase 3
0.7 Intermediate Similarity NPD7157 Approved
0.6994 Remote Similarity NPD1465 Phase 2
0.6994 Remote Similarity NPD2393 Clinical (unspecified phase)
0.6994 Remote Similarity NPD2801 Approved
0.6993 Remote Similarity NPD4108 Discontinued
0.6986 Remote Similarity NPD3225 Approved
0.6985 Remote Similarity NPD2684 Approved
0.6981 Remote Similarity NPD1940 Clinical (unspecified phase)
0.698 Remote Similarity NPD7095 Approved
0.6978 Remote Similarity NPD1398 Phase 1
0.6977 Remote Similarity NPD7240 Approved
0.6974 Remote Similarity NPD6653 Approved
0.6966 Remote Similarity NPD2235 Phase 2
0.6966 Remote Similarity NPD2231 Phase 2
0.6962 Remote Similarity NPD7041 Phase 2
0.6962 Remote Similarity NPD7040 Clinical (unspecified phase)
0.6954 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6954 Remote Similarity NPD5837 Clinical (unspecified phase)
0.6954 Remote Similarity NPD4140 Approved
0.6954 Remote Similarity NPD3620 Phase 2
0.695 Remote Similarity NPD7340 Approved
0.6948 Remote Similarity NPD6099 Approved
0.6948 Remote Similarity NPD6100 Approved
0.6937 Remote Similarity NPD5403 Approved
0.6936 Remote Similarity NPD7549 Discontinued
0.6933 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6918 Remote Similarity NPD5401 Approved
0.6915 Remote Similarity NPD7783 Phase 2
0.6915 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6912 Remote Similarity NPD2342 Discontinued
0.6908 Remote Similarity NPD5124 Phase 1
0.6908 Remote Similarity NPD6355 Discontinued
0.6908 Remote Similarity NPD5123 Clinical (unspecified phase)
0.6906 Remote Similarity NPD7843 Approved
0.6903 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6903 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6903 Remote Similarity NPD2029 Clinical (unspecified phase)
0.6897 Remote Similarity NPD422 Phase 1
0.689 Remote Similarity NPD5929 Approved
0.6883 Remote Similarity NPD7033 Discontinued
0.6883 Remote Similarity NPD3748 Approved
0.6879 Remote Similarity NPD6398 Clinical (unspecified phase)
0.6867 Remote Similarity NPD3749 Approved
0.6859 Remote Similarity NPD1549 Phase 2
0.6859 Remote Similarity NPD7037 Approved
0.6857 Remote Similarity NPD4869 Clinical (unspecified phase)
0.6855 Remote Similarity NPD1511 Approved
0.6848 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6842 Remote Similarity NPD2238 Phase 2
0.6839 Remote Similarity NPD6032 Approved
0.6835 Remote Similarity NPD228 Approved
0.6831 Remote Similarity NPD6781 Approved
0.6831 Remote Similarity NPD6778 Approved
0.6831 Remote Similarity NPD6782 Approved
0.6831 Remote Similarity NPD6776 Approved
0.6831 Remote Similarity NPD6777 Approved
0.6831 Remote Similarity NPD6780 Approved
0.6831 Remote Similarity NPD6779 Approved
0.6824 Remote Similarity NPD2797 Approved
0.6824 Remote Similarity NPD3094 Phase 2
0.6821 Remote Similarity NPD7985 Registered
0.6818 Remote Similarity NPD4978 Clinical (unspecified phase)
0.6815 Remote Similarity NPD5061 Approved
0.6815 Remote Similarity NPD5177 Phase 3
0.6815 Remote Similarity NPD5062 Approved
0.6813 Remote Similarity NPD4160 Clinical (unspecified phase)
0.6807 Remote Similarity NPD7768 Phase 2
0.6806 Remote Similarity NPD1357 Approved
0.6805 Remote Similarity NPD6232 Discontinued
0.6805 Remote Similarity NPD7229 Phase 3
0.6803 Remote Similarity NPD6582 Phase 2
0.6803 Remote Similarity NPD6583 Phase 3
0.6803 Remote Similarity NPD5327 Phase 3
0.6788 Remote Similarity NPD7819 Suspended
0.6786 Remote Similarity NPD4666 Phase 3
0.6786 Remote Similarity NPD7635 Approved
0.6781 Remote Similarity NPD1535 Discovery
0.6776 Remote Similarity NPD4475 Approved
0.6776 Remote Similarity NPD4474 Approved
0.6772 Remote Similarity NPD4628 Phase 3
0.677 Remote Similarity NPD1512 Approved
0.6766 Remote Similarity NPD7075 Discontinued
0.6761 Remote Similarity NPD8053 Approved
0.6761 Remote Similarity NPD8054 Approved
0.6757 Remote Similarity NPD6823 Phase 2
0.6752 Remote Similarity NPD2424 Discontinued
0.675 Remote Similarity NPD6143 Clinical (unspecified phase)
0.675 Remote Similarity NPD6087 Phase 1
0.6738 Remote Similarity NPD5283 Phase 1
0.6735 Remote Similarity NPD1481 Phase 2
0.6735 Remote Similarity NPD1840 Phase 2
0.6735 Remote Similarity NPD1608 Approved
0.6733 Remote Similarity NPD3018 Phase 2
0.6732 Remote Similarity NPD3597 Clinical (unspecified phase)
0.6731 Remote Similarity NPD2935 Discontinued
0.6731 Remote Similarity NPD1551 Phase 2
0.6726 Remote Similarity NPD5709 Phase 3
0.6725 Remote Similarity NPD7852 Clinical (unspecified phase)
0.6725 Remote Similarity NPD2489 Approved
0.6725 Remote Similarity NPD27 Approved
0.6724 Remote Similarity NPD6184 Discontinued
0.6723 Remote Similarity NPD8055 Clinical (unspecified phase)
0.672 Remote Similarity NPD7435 Discontinued
0.6711 Remote Similarity NPD6812 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   15224599
ChEMBL   CHEMBL3342631
ZINC  

Physicochemical Properties

Molecular Weight:  334.08
ALogP:  -1.2517
MLogP:  3.11
XLogP:  3.308
# Rotatable Bonds:  3
Polar Surface Area:  79.15
# H-Bond Aceptor:  1
# H-Bond Donor:  3
# Rings:  5
# Heavy Atoms:  25

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
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