In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (1R,8aR)-N-[(2-prop-2-ynoxyphenyl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1R,8aR)-N-[(2-prop-2-ynoxypheny…
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) | 2.71 | 7.5 | -33.17 | 2 | 3 | 1 | 29 | 285.411 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.71 | 9.76 | -104.7 | 3 | 3 | 2 | 30 | 286.419 | 5 | ↓ |