Drug ID:   | NPD8946 |
Drug Name:   | Fluciclovine |
Molecular Formula:   | C6H10FNO2 |
Canonical SMILES:   | OC(=O)[C@]1(N)C[C@](C1)(C)F |
Standard InCHI:   | InChI=1S/C6H10FNO2/c1-5(7)2-6(8,3-5)4(9)10/h2-3,8H2,1H3,(H,9,10)/t5-,6- |
Standard InCHIKey:   | ILMJJAKSEOUEPX-IZLXSQMJSA-N |
Max Developmental Stage:   | Approved |
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 |
---|---|---|
Intermediate Similarity | 0.8 | NPC245027 |
Intermediate Similarity | 0.8 | NPC62045 |
Intermediate Similarity | 0.8 | NPC162620 |
Intermediate Similarity | 0.7692 | NPC155512 |
Intermediate Similarity | 0.7647 | NPC43204 |
Intermediate Similarity | 0.7647 | NPC84636 |
Intermediate Similarity | 0.7647 | NPC226027 |
Intermediate Similarity | 0.7647 | NPC174246 |
Intermediate Similarity | 0.7551 | NPC118459 |
Intermediate Similarity | 0.7551 | NPC327698 |
Intermediate Similarity | 0.7333 | NPC9294 |
Intermediate Similarity | 0.7 | NPC132307 |
Intermediate Similarity | 0.7 | NPC325097 |
Intermediate Similarity | 0.7 | NPC126925 |
Remote Similarity | 0.6792 | NPC93081 |
Remote Similarity | 0.6792 | NPC140872 |
Remote Similarity | 0.678 | NPC327748 |
Remote Similarity | 0.678 | NPC321468 |
Remote Similarity | 0.6735 | NPC168375 |
Remote Similarity | 0.6735 | NPC121517 |
Remote Similarity | 0.6735 | NPC326992 |
Remote Similarity | 0.6727 | NPC322946 |
Remote Similarity | 0.6724 | NPC317147 |
Remote Similarity | 0.6667 | NPC329564 |
Remote Similarity | 0.6667 | NPC324825 |
Remote Similarity | 0.6667 | NPC112890 |
Remote Similarity | 0.6667 | NPC327170 |
Remote Similarity | 0.6667 | NPC316231 |
Remote Similarity | 0.661 | NPC190385 |
Remote Similarity | 0.6545 | NPC273330 |
Remote Similarity | 0.6545 | NPC137958 |
Remote Similarity | 0.65 | NPC317143 |
Remote Similarity | 0.65 | NPC316826 |
Remote Similarity | 0.6471 | NPC167986 |
Remote Similarity | 0.6471 | NPC276294 |
Remote Similarity | 0.6471 | NPC291186 |
Remote Similarity | 0.6441 | NPC318260 |
Remote Similarity | 0.6379 | NPC2801 |
Remote Similarity | 0.6346 | NPC323974 |
Remote Similarity | 0.6316 | NPC197087 |
Remote Similarity | 0.6316 | NPC190184 |
Remote Similarity | 0.6271 | NPC38463 |
Remote Similarity | 0.6226 | NPC329263 |
Remote Similarity | 0.6207 | NPC183845 |
Remote Similarity | 0.6207 | NPC279661 |
Remote Similarity | 0.6167 | NPC278209 |
Remote Similarity | 0.6154 | NPC107645 |
Remote Similarity | 0.6122 | NPC252843 |
Remote Similarity | 0.6102 | NPC322573 |
Remote Similarity | 0.6078 | NPC53449 |
Remote Similarity | 0.6078 | NPC66043 |
Remote Similarity | 0.6071 | NPC328378 |
Remote Similarity | 0.6066 | NPC176164 |
Remote Similarity | 0.6066 | NPC189301 |
Remote Similarity | 0.6 | NPC325454 |
Remote Similarity | 0.6 | NPC174368 |
Remote Similarity | 0.6 | NPC38930 |
Remote Similarity | 0.6 | NPC101249 |
Remote Similarity | 0.6 | NPC18188 |
Remote Similarity | 0.6 | NPC325985 |
Remote Similarity | 0.5968 | NPC254541 |
Remote Similarity | 0.5932 | NPC316889 |
Remote Similarity | 0.5932 | NPC321118 |
Remote Similarity | 0.5918 | NPC272614 |
Remote Similarity | 0.5918 | NPC116709 |
Remote Similarity | 0.5918 | NPC21290 |
Remote Similarity | 0.5882 | NPC3531 |
Remote Similarity | 0.5821 | NPC188231 |
Remote Similarity | 0.5821 | NPC222327 |
Remote Similarity | 0.5818 | NPC136476 |
Remote Similarity | 0.5818 | NPC49952 |
Remote Similarity | 0.5806 | NPC302003 |
Remote Similarity | 0.5806 | NPC319279 |
Remote Similarity | 0.5806 | NPC245346 |
Remote Similarity | 0.5806 | NPC11433 |
Remote Similarity | 0.5789 | NPC170739 |
Remote Similarity | 0.5789 | NPC93888 |
Remote Similarity | 0.5789 | NPC152451 |
Remote Similarity | 0.5789 | NPC193989 |
Remote Similarity | 0.5789 | NPC270805 |
Remote Similarity | 0.5763 | NPC189178 |
Remote Similarity | 0.5763 | NPC263065 |
Remote Similarity | 0.5745 | NPC280532 |
Remote Similarity | 0.5741 | NPC198301 |
Remote Similarity | 0.5714 | NPC276928 |
Remote Similarity | 0.5714 | NPC136159 |
Remote Similarity | 0.5714 | NPC64250 |
Remote Similarity | 0.5714 | NPC320598 |
Remote Similarity | 0.5714 | NPC321536 |
Remote Similarity | 0.5714 | NPC268927 |
Remote Similarity | 0.569 | NPC315977 |
Remote Similarity | 0.569 | NPC50457 |
Remote Similarity | 0.566 | NPC325452 |
Remote Similarity | 0.566 | NPC248763 |
Remote Similarity | 0.5652 | NPC15864 |
Remote Similarity | 0.5652 | NPC122768 |
Remote Similarity | 0.5652 | NPC61066 |
Remote Similarity | 0.5652 | NPC151140 |
Remote Similarity | 0.5652 | NPC104195 |
Remote Similarity | 0.5636 | NPC285322 |
Remote Similarity | 0.5636 | NPC208793 |
Remote Similarity | 0.5625 | NPC175342 |
Remote Similarity | 0.5625 | NPC143722 |
Remote Similarity | 0.5625 | NPC68974 |
Remote Similarity | 0.5614 | NPC153370 |
Molecular Weight   | 147.07 |
ALogP   | -0.5155 |
MLogP   | 1.68 |
XLogP   | -2.157 |
HDA   | 3 |
HBD   | 2 |
Rotatable Bonds   | 5 |
TPSA   | 63.32 |
RO5 Violation   | 0 |