In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 25 | Yes |
Popular Name: 3-[7-methyl-3-[[(2R)-2-methyl-1-piperidyl]methyl]imidazo[1,2-a]pyridin-2-yl]aniline 3-[7-methyl-3-[[(2R)-2-methyl-1-…
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) | 3.71 | 9.95 | -40.68 | 3 | 4 | 1 | 48 | 335.475 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.71 | 7.68 | -11.82 | 2 | 4 | 0 | 47 | 334.467 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 10.36 | -84.99 | 4 | 4 | 2 | 49 | 336.483 | 3 | ↓ |