In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 14 | Yes |
Popular Name: [(2R,3R)-1-methyl-2-(5-methyl-2-thienyl)pyrrolidin-3-yl]methanamine [(2R,3R)-1-methyl-2-(5-methyl-2-…
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) | 1.35 | 2.92 | -43.38 | 3 | 2 | 1 | 31 | 211.354 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.35 | 5.18 | -99.7 | 4 | 2 | 2 | 32 | 212.362 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.