In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2010 | 20 | Yes |
Popular Name: (1R,2S)-N2-[(1S)-1-cyclopropylethyl]-N2-(2-methoxyethyl)-1-phenyl-propane-1,2-diamine (1R,2S)-N2-[(1S)-1-cyclopropylet…
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) | 0.97 | 5.14 | -43.95 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 4.8 | -3.1 | 2 | 3 | 0 | 38 | 276.424 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.97 | 6.74 | -26.91 | 3 | 3 | 1 | 40 | 277.432 | 8 | ↓ |