In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 21 | Yes |
Popular Name: (1R,8aR)-N-[(1S)-1-(4-chlorophenyl)butyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1R,8aR)-N-[(1S)-1-(4-chlorophen…
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) | 3.94 | 10.62 | -32.6 | 2 | 2 | 1 | 16 | 307.889 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.94 | 8.4 | -1.66 | 1 | 2 | 0 | 15 | 306.881 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 11.58 | -114.64 | 3 | 2 | 2 | 21 | 308.897 | 5 | ↓ |