In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (1R,2R)-N1-(1-ethylpropyl)-N1-(2-methoxyethyl)-1-phenyl-propane-1,2-diamine (1R,2R)-N1-(1-ethylpropyl)-N1-(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) | 2.86 | 6.28 | -117.58 | 4 | 3 | 2 | 41 | 280.456 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 5.53 | -40.83 | 3 | 3 | 1 | 40 | 279.448 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 6.21 | -25.39 | 3 | 3 | 1 | 40 | 279.448 | 9 | ↓ |