In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 16 | Yes |
Popular Name: (1S,8aR)-N-(2-thienylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-(2-thienylmethyl)-1,2…
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) | 2.44 | 6.6 | -32.38 | 2 | 2 | 1 | 16 | 237.392 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.44 | 5.48 | -38.92 | 2 | 2 | 1 | 20 | 237.392 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.44 | 7.74 | -108.62 | 3 | 2 | 2 | 21 | 238.4 | 3 | ↓ |