In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 15 | Yes |
Popular Name: [(3R)-1-[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]pyrrolidin-3-yl]methanamine [(3R)-1-[(1S,8R)-2,3,5,6,7,8-hex…
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) | 0.19 | 0.04 | -43.74 | 3 | 3 | 1 | 34 | 210.345 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.19 | 4.58 | -99.86 | 4 | 3 | 2 | 35 | 211.353 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.19 | 2.39 | -104.73 | 4 | 3 | 2 | 35 | 211.353 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.19 | 2.6 | -84.56 | 4 | 3 | 2 | 35 | 211.353 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.