In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 15 | Yes |
Popular Name: (3S)-3-(2-amino-5-methyl-3-pyridyl)-1-methyl-pyrrolidin-3-ol (3S)-3-(2-amino-5-methyl-3-pyrid…
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) | 0.46 | 2.23 | -37.61 | 4 | 4 | 1 | 64 | 208.285 | 1 | ↓ |
Lo Low (pH 4.5-6) | 0.46 | 2.71 | -86.84 | 5 | 4 | 2 | 65 | 209.293 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.