In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: (1S,8aR)-N-[(4S)-6-chlorothiochroman-4-yl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(4S)-6-chlorothiochr…
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) | 2.99 | 9.19 | -33.66 | 2 | 2 | 1 | 16 | 323.913 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 8.26 | -41.85 | 2 | 2 | 1 | 20 | 323.913 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.99 | 10.52 | -118.51 | 3 | 2 | 2 | 21 | 324.921 | 2 | ↓ |