In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 16 | Yes |
Popular Name: (1S,8aR)-N-pyrimidin-4-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-pyrimidin-4-yl-1,2,3,…
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) | 1.04 | 6.61 | -39.5 | 2 | 4 | 1 | 42 | 219.312 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.04 | 7.11 | -85.66 | 3 | 4 | 2 | 43 | 220.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.