In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | Yes |
Popular Name: N-methyl-1-[(2S,3R)-1-methyl-2-(1-methylpyrazol-4-yl)pyrrolidin-3-yl]methanamine N-methyl-1-[(2S,3R)-1-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) | 0.59 | 2 | -43.1 | 2 | 4 | 1 | 38 | 209.317 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.59 | 4.47 | -101.41 | 3 | 4 | 2 | 39 | 210.325 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.