Drug ID:   | NPD9537 |
Drug Name:   | Fluorodopa F 18 |
Molecular Formula:   | C9H10FNO4 |
Canonical SMILES:   | OC(=O)C(Cc1cc(O)c(cc1[18F])O)N |
Standard InCHI:   | InChI=1S/C9H10FNO4/c10-5-3-8(13)7(12)2-4(5)1-6(11)9(14)15/h2-3,6,12-13H,1,11H2,(H,14,15)/i10-1 |
Standard InCHIKey:   | PAXWQORCRCBOCU-LMANFOLPSA-N |
Max Developmental Stage:   | Phase 1 |
Max Developmental Stage Source:   | ChEMBL |
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
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
Similarity Level | Similarity Score | Natural Product ID |
---|---|---|
High Similarity | 0.9675 | NPC145888 |
High Similarity | 0.9675 | NPC161593 |
High Similarity | 0.9675 | NPC16031 |
High Similarity | 0.937 | NPC88667 |
High Similarity | 0.9127 | NPC321561 |
High Similarity | 0.8815 | NPC66518 |
High Similarity | 0.8699 | NPC106551 |
High Similarity | 0.8699 | NPC281686 |
High Similarity | 0.8699 | NPC188867 |
High Similarity | 0.8582 | NPC6913 |
Intermediate Similarity | 0.8492 | NPC239697 |
Intermediate Similarity | 0.8413 | NPC142638 |
Intermediate Similarity | 0.8413 | NPC317784 |
Intermediate Similarity | 0.8374 | NPC146422 |
Intermediate Similarity | 0.8295 | NPC27581 |
Intermediate Similarity | 0.8217 | NPC326079 |
Intermediate Similarity | 0.8211 | NPC222084 |
Intermediate Similarity | 0.8062 | NPC319950 |
Intermediate Similarity | 0.8016 | NPC148969 |
Intermediate Similarity | 0.8 | NPC325651 |
Intermediate Similarity | 0.8 | NPC169207 |
Intermediate Similarity | 0.8 | NPC115627 |
Intermediate Similarity | 0.8 | NPC118522 |
Intermediate Similarity | 0.7984 | NPC85276 |
Intermediate Similarity | 0.7891 | NPC4665 |
Intermediate Similarity | 0.7879 | NPC142577 |
Intermediate Similarity | 0.7754 | NPC48909 |
Intermediate Similarity | 0.771 | NPC63126 |
Intermediate Similarity | 0.7674 | NPC142599 |
Intermediate Similarity | 0.7669 | NPC56634 |
Intermediate Similarity | 0.7642 | NPC68055 |
Intermediate Similarity | 0.7639 | NPC13696 |
Intermediate Similarity | 0.763 | NPC13020 |
Intermediate Similarity | 0.763 | NPC318777 |
Intermediate Similarity | 0.763 | NPC140359 |
Intermediate Similarity | 0.7626 | NPC326966 |
Intermediate Similarity | 0.7626 | NPC45191 |
Intermediate Similarity | 0.7591 | NPC476353 |
Intermediate Similarity | 0.7591 | NPC323775 |
Intermediate Similarity | 0.7591 | NPC236347 |
Intermediate Similarity | 0.7571 | NPC302171 |
Intermediate Similarity | 0.7571 | NPC300020 |
Intermediate Similarity | 0.7571 | NPC33338 |
Intermediate Similarity | 0.7536 | NPC296712 |
Intermediate Similarity | 0.75 | NPC318984 |
Intermediate Similarity | 0.75 | NPC197239 |
Intermediate Similarity | 0.75 | NPC241086 |
Intermediate Similarity | 0.75 | NPC317741 |
Intermediate Similarity | 0.75 | NPC328137 |
Intermediate Similarity | 0.75 | NPC282087 |
Intermediate Similarity | 0.75 | NPC259800 |
Intermediate Similarity | 0.75 | NPC326860 |
Intermediate Similarity | 0.75 | NPC318028 |
Intermediate Similarity | 0.7482 | NPC478147 |
Intermediate Similarity | 0.7481 | NPC177291 |
Intermediate Similarity | 0.7481 | NPC194416 |
Intermediate Similarity | 0.7481 | NPC472271 |
Intermediate Similarity | 0.7481 | NPC322332 |
Intermediate Similarity | 0.746 | NPC294902 |
Intermediate Similarity | 0.746 | NPC1786 |
Intermediate Similarity | 0.746 | NPC1075 |
Intermediate Similarity | 0.7447 | NPC244866 |
Intermediate Similarity | 0.7431 | NPC48202 |
Intermediate Similarity | 0.7424 | NPC61062 |
Intermediate Similarity | 0.7424 | NPC277394 |
Intermediate Similarity | 0.7424 | NPC299252 |
Intermediate Similarity | 0.7398 | NPC125732 |
Intermediate Similarity | 0.7398 | NPC245561 |
Intermediate Similarity | 0.7391 | NPC318965 |
Intermediate Similarity | 0.7388 | NPC268572 |
Intermediate Similarity | 0.7376 | NPC329595 |
Intermediate Similarity | 0.7376 | NPC326599 |
Intermediate Similarity | 0.7372 | NPC158900 |
Intermediate Similarity | 0.7365 | NPC125852 |
Intermediate Similarity | 0.7353 | NPC474862 |
Intermediate Similarity | 0.7339 | NPC52472 |
Intermediate Similarity | 0.7329 | NPC323123 |
Intermediate Similarity | 0.7328 | NPC264558 |
Intermediate Similarity | 0.7328 | NPC309808 |
Intermediate Similarity | 0.7319 | NPC85565 |
Intermediate Similarity | 0.7319 | NPC471927 |
Intermediate Similarity | 0.7319 | NPC288945 |
Intermediate Similarity | 0.7317 | NPC109955 |
Intermediate Similarity | 0.7313 | NPC122009 |
Intermediate Similarity | 0.7287 | NPC326187 |
Intermediate Similarity | 0.7287 | NPC290566 |
Intermediate Similarity | 0.7287 | NPC145638 |
Intermediate Similarity | 0.7279 | NPC284078 |
Intermediate Similarity | 0.7266 | NPC280767 |
Intermediate Similarity | 0.726 | NPC211468 |
Intermediate Similarity | 0.726 | NPC170170 |
Intermediate Similarity | 0.726 | NPC219233 |
Intermediate Similarity | 0.7259 | NPC156654 |
Intermediate Similarity | 0.7244 | NPC13495 |
Intermediate Similarity | 0.7239 | NPC150919 |
Intermediate Similarity | 0.7239 | NPC283468 |
Intermediate Similarity | 0.7236 | NPC293628 |
Intermediate Similarity | 0.7236 | NPC122493 |
Intermediate Similarity | 0.7236 | NPC10781 |
Intermediate Similarity | 0.7236 | NPC324569 |
Intermediate Similarity | 0.7206 | NPC34634 |
Intermediate Similarity | 0.7206 | NPC265454 |
Intermediate Similarity | 0.72 | NPC17760 |
Intermediate Similarity | 0.7188 | NPC317592 |
Intermediate Similarity | 0.7185 | NPC205502 |
Intermediate Similarity | 0.7176 | NPC163674 |
Intermediate Similarity | 0.7176 | NPC226250 |
Intermediate Similarity | 0.7172 | NPC6570 |
Intermediate Similarity | 0.7171 | NPC241392 |
Intermediate Similarity | 0.7165 | NPC52087 |
Intermediate Similarity | 0.7165 | NPC471511 |
Intermediate Similarity | 0.7163 | NPC281020 |
Intermediate Similarity | 0.7153 | NPC98305 |
Intermediate Similarity | 0.7153 | NPC236520 |
Intermediate Similarity | 0.7153 | NPC294361 |
Intermediate Similarity | 0.7143 | NPC221870 |
Intermediate Similarity | 0.7143 | NPC110764 |
Intermediate Similarity | 0.7132 | NPC283760 |
Intermediate Similarity | 0.7132 | NPC299406 |
Intermediate Similarity | 0.7121 | NPC131530 |
Intermediate Similarity | 0.7121 | NPC48525 |
Intermediate Similarity | 0.7113 | NPC271808 |
Intermediate Similarity | 0.7111 | NPC200988 |
Intermediate Similarity | 0.7111 | NPC137096 |
Intermediate Similarity | 0.7111 | NPC145023 |
Intermediate Similarity | 0.7111 | NPC278652 |
Intermediate Similarity | 0.7111 | NPC610 |
Intermediate Similarity | 0.7111 | NPC175799 |
Intermediate Similarity | 0.7111 | NPC120075 |
Intermediate Similarity | 0.7087 | NPC196479 |
Intermediate Similarity | 0.7083 | NPC470392 |
Intermediate Similarity | 0.7075 | NPC238412 |
Intermediate Similarity | 0.7068 | NPC95381 |
Intermediate Similarity | 0.7063 | NPC241354 |
Intermediate Similarity | 0.7063 | NPC29601 |
Intermediate Similarity | 0.7063 | NPC223393 |
Intermediate Similarity | 0.7059 | NPC203124 |
Intermediate Similarity | 0.7059 | NPC309434 |
Intermediate Similarity | 0.7059 | NPC86198 |
Intermediate Similarity | 0.705 | NPC225710 |
Intermediate Similarity | 0.705 | NPC86900 |
Intermediate Similarity | 0.7045 | NPC297657 |
Intermediate Similarity | 0.7045 | NPC280382 |
Intermediate Similarity | 0.7042 | NPC158654 |
Intermediate Similarity | 0.704 | NPC260000 |
Intermediate Similarity | 0.7034 | NPC243404 |
Intermediate Similarity | 0.7031 | NPC120719 |
Intermediate Similarity | 0.7031 | NPC79672 |
Intermediate Similarity | 0.7031 | NPC12278 |
Intermediate Similarity | 0.7023 | NPC71266 |
Intermediate Similarity | 0.702 | NPC294249 |
Intermediate Similarity | 0.7016 | NPC107522 |
Intermediate Similarity | 0.7015 | NPC33749 |
Intermediate Similarity | 0.7015 | NPC328593 |
Intermediate Similarity | 0.7015 | NPC217472 |
Intermediate Similarity | 0.7015 | NPC261453 |
Intermediate Similarity | 0.7007 | NPC141791 |
Intermediate Similarity | 0.7007 | NPC70084 |
Intermediate Similarity | 0.7007 | NPC470214 |
Intermediate Similarity | 0.7007 | NPC263386 |
Intermediate Similarity | 0.7007 | NPC470215 |
Intermediate Similarity | 0.7007 | NPC109371 |
Intermediate Similarity | 0.7 | NPC163083 |
Remote Similarity | 0.6992 | NPC51698 |
Remote Similarity | 0.6984 | NPC280869 |
Remote Similarity | 0.6984 | NPC131587 |
Remote Similarity | 0.698 | NPC91953 |
Remote Similarity | 0.6978 | NPC201777 |
Remote Similarity | 0.6978 | NPC211992 |
Remote Similarity | 0.6977 | NPC239291 |
Remote Similarity | 0.6966 | NPC318799 |
Remote Similarity | 0.6966 | NPC198388 |
Remote Similarity | 0.6966 | NPC208757 |
Remote Similarity | 0.6963 | NPC10286 |
Remote Similarity | 0.6963 | NPC474967 |
Remote Similarity | 0.6963 | NPC213 |
Remote Similarity | 0.6963 | NPC233669 |
Remote Similarity | 0.6959 | NPC471283 |
Remote Similarity | 0.6957 | NPC260837 |
Remote Similarity | 0.6953 | NPC13426 |
Remote Similarity | 0.6947 | NPC31274 |
Remote Similarity | 0.6944 | NPC94810 |
Remote Similarity | 0.6944 | NPC226855 |
Remote Similarity | 0.6939 | NPC109580 |
Remote Similarity | 0.6934 | NPC104514 |
Remote Similarity | 0.6934 | NPC275519 |
Remote Similarity | 0.6929 | NPC114298 |
Remote Similarity | 0.6923 | NPC19149 |
Remote Similarity | 0.6923 | NPC291847 |
Remote Similarity | 0.6923 | NPC477814 |
Remote Similarity | 0.6923 | NPC153990 |
Remote Similarity | 0.6918 | NPC25581 |
Remote Similarity | 0.6918 | NPC18074 |
Remote Similarity | 0.6918 | NPC61 |
Remote Similarity | 0.6918 | NPC5419 |
Remote Similarity | 0.6917 | NPC21890 |
Remote Similarity | 0.6913 | NPC197921 |
Remote Similarity | 0.6912 | NPC281277 |
Remote Similarity | 0.6906 | NPC470848 |
Remote Similarity | 0.6906 | NPC470849 |
Molecular Weight   | 215.06 |
ALogP   | -1.5253 |
MLogP   | 1.79 |
XLogP   | -2.152 |
HDA   | 3 |
HBD   | 4 |
Rotatable Bonds   | 8 |
TPSA   | 103.78 |
RO5 Violation   | 0 |