Drug ID:   | NPD322 |
Drug Name:   | Fasoracetam |
Molecular Formula:   | C10H16N2O2 |
Canonical SMILES:   | OC1=N[C@H](CC1)C(=O)N1CCCCC1 |
Standard InCHI:   | InChI=1S/C10H16N2O2/c13-9-5-4-8(11-9)10(14)12-6-2-1-3-7-12/h8H,1-7H2,(H,11,13)/t8-/m1/s1 |
Standard InCHIKey:   | GOWRRBABHQUJMX-MRVPVSSYSA-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 |
---|---|---|
Intermediate Similarity | 0.7681 | NPC128005 |
Intermediate Similarity | 0.7681 | NPC84182 |
Intermediate Similarity | 0.7671 | NPC161774 |
Intermediate Similarity | 0.7671 | NPC266888 |
Intermediate Similarity | 0.7671 | NPC209156 |
Intermediate Similarity | 0.7671 | NPC256312 |
Intermediate Similarity | 0.7639 | NPC214532 |
Intermediate Similarity | 0.7639 | NPC196007 |
Intermediate Similarity | 0.7639 | NPC76297 |
Intermediate Similarity | 0.76 | NPC59867 |
Intermediate Similarity | 0.75 | NPC243964 |
Intermediate Similarity | 0.7403 | NPC312315 |
Intermediate Similarity | 0.7215 | NPC475542 |
Intermediate Similarity | 0.7162 | NPC470781 |
Intermediate Similarity | 0.7 | NPC470783 |
Remote Similarity | 0.6974 | NPC126186 |
Remote Similarity | 0.6795 | NPC470782 |
Remote Similarity | 0.6543 | NPC31756 |
Remote Similarity | 0.6486 | NPC287693 |
Remote Similarity | 0.6463 | NPC476156 |
Remote Similarity | 0.6463 | NPC476117 |
Remote Similarity | 0.6463 | NPC476137 |
Remote Similarity | 0.6463 | NPC476243 |
Remote Similarity | 0.6447 | NPC322274 |
Remote Similarity | 0.641 | NPC29326 |
Remote Similarity | 0.6386 | NPC476302 |
Remote Similarity | 0.6338 | NPC34838 |
Remote Similarity | 0.6338 | NPC292299 |
Remote Similarity | 0.6329 | NPC320221 |
Remote Similarity | 0.631 | NPC84128 |
Remote Similarity | 0.631 | NPC53858 |
Remote Similarity | 0.6269 | NPC19576 |
Remote Similarity | 0.6269 | NPC29950 |
Remote Similarity | 0.625 | NPC327272 |
Remote Similarity | 0.625 | NPC263207 |
Remote Similarity | 0.6216 | NPC57420 |
Remote Similarity | 0.6118 | NPC184473 |
Remote Similarity | 0.6111 | NPC474593 |
Remote Similarity | 0.6111 | NPC475801 |
Remote Similarity | 0.6087 | NPC301010 |
Remote Similarity | 0.6044 | NPC474576 |
Remote Similarity | 0.6023 | NPC477539 |
Remote Similarity | 0.6022 | NPC280066 |
Remote Similarity | 0.6 | NPC275715 |
Remote Similarity | 0.5978 | NPC173763 |
Remote Similarity | 0.5978 | NPC471098 |
Remote Similarity | 0.5978 | NPC62263 |
Remote Similarity | 0.5977 | NPC472351 |
Remote Similarity | 0.5938 | NPC475440 |
Remote Similarity | 0.593 | NPC6902 |
Remote Similarity | 0.5921 | NPC262615 |
Remote Similarity | 0.589 | NPC321536 |
Remote Similarity | 0.5882 | NPC327239 |
Remote Similarity | 0.5867 | NPC105297 |
Remote Similarity | 0.5814 | NPC23984 |
Remote Similarity | 0.5811 | NPC143722 |
Remote Similarity | 0.5775 | NPC322573 |
Remote Similarity | 0.5773 | NPC475188 |
Remote Similarity | 0.5747 | NPC284456 |
Remote Similarity | 0.5729 | NPC473597 |
Remote Similarity | 0.5714 | NPC473495 |
Remote Similarity | 0.5714 | NPC128559 |
Remote Similarity | 0.5699 | NPC477538 |
Remote Similarity | 0.5696 | NPC250953 |
Remote Similarity | 0.5696 | NPC306696 |
Remote Similarity | 0.5694 | NPC325985 |
Remote Similarity | 0.5694 | NPC38463 |
Remote Similarity | 0.5682 | NPC235078 |
Remote Similarity | 0.5679 | NPC328457 |
Remote Similarity | 0.5676 | NPC320598 |
Remote Similarity | 0.5676 | NPC254541 |
Remote Similarity | 0.5658 | NPC327252 |
Remote Similarity | 0.5625 | NPC117829 |
TTD   | DIB016924 |
DrugBank   | |
ChEMBL   | |
IUPHAR/BPS   | |
PharmaGKB   | |
KEGG Drug   | |
PubChem CID   | |
ChEBI   | |
CAS Number   |
Molecular Weight   | 196.12 |
ALogP   | -1.9675 |
MLogP   | 2.12 |
XLogP   | 0.149 |
HDA   | 4 |
HBD   | 1 |
Rotatable Bonds   | 3 |
TPSA   | 52.9 |
RO5 Violation   | 0 |