In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 17 | Yes |
Popular Name: (1R,8aR)-N-[(5-chloro-2-thienyl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1R,8aR)-N-[(5-chloro-2-thienyl)…
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) | 3.24 | 7.41 | -32.22 | 2 | 2 | 1 | 16 | 271.837 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.24 | 6.41 | -41.6 | 2 | 2 | 1 | 20 | 271.837 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.24 | 8.66 | -114.52 | 3 | 2 | 2 | 21 | 272.845 | 3 | ↓ |