In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 13 | Yes |
Popular Name: (2S)-1-(ethylamino)-3-[2-methoxyethyl(methyl)amino]propan-2-ol (2S)-1-(ethylamino)-3-[2-methoxy…
None
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) | -0.51 | 1.03 | -96.56 | 4 | 4 | 2 | 51 | 192.303 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.51 | -0.86 | -31.69 | 2 | 4 | 0 | 52 | 190.287 | 8 | ↓ |
Hi High (pH 8-9.5) | -0.51 | -1.38 | -38.35 | 3 | 4 | 1 | 49 | 191.295 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.51 | 1.56 | -42.48 | 3 | 4 | 1 | 53 | 191.295 | 8 | ↓ |