In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: 2-[[(1R,2R)-2-amino-1-(p-tolyl)butyl]-methyl-amino]-N-methyl-acetamide 2-[[(1R,2R)-2-amino-1-(p-tolyl)b…
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) | 1.72 | 4.82 | -116.88 | 5 | 4 | 2 | 61 | 265.401 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 4.51 | -35.45 | 4 | 4 | 1 | 60 | 264.393 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 2.83 | -55.39 | 4 | 4 | 1 | 60 | 264.393 | 6 | ↓ |