In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2010 | 14 | Yes |
Popular Name: 1-ethyl-3-[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]guanidine 1-ethyl-3-[(1S,8R)-2,3,5,6,7,8-h…
None
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) | 0.46 | 5.22 | -86.1 | 5 | 4 | 2 | 54 | 198.314 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.46 | 2.69 | -29.11 | 4 | 4 | 1 | 53 | 197.306 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.