In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | Yes |
Popular Name: (2S)-1-(cyclopropylamino)-3-[methyl(2-pyridylmethyl)amino]propan-2-ol (2S)-1-(cyclopropylamino)-3-[met…
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) | 0.08 | 1.29 | -38.98 | 3 | 4 | 1 | 53 | 236.339 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 2.01 | -79.62 | 4 | 4 | 2 | 54 | 237.347 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.08 | 4.22 | -44.31 | 3 | 4 | 1 | 57 | 236.339 | 7 | ↓ |