In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 21 | Yes |
Popular Name: 5-[[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]carbamoylamino]pyridine-3-carboxylic 5-[[(1S,8R)-2,3,5,6,7,8-hexahydr…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.47 | 4.3 | -79.98 | 3 | 7 | 0 | 99 | 290.323 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.47 | 4.76 | -91.95 | 4 | 7 | 1 | 100 | 291.331 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.