In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-N1-[(1S)-1-cyclopropylethyl]-N1-(2-methoxyethyl)-1-(p-tolyl)propane-1,2-diamine (1S,2S)-N1-[(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) | 2.76 | 7.26 | -104.25 | 4 | 3 | 2 | 41 | 292.467 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.76 | 6.77 | -27.53 | 3 | 3 | 1 | 40 | 291.459 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.76 | 5.74 | -35.42 | 3 | 3 | 1 | 40 | 291.459 | 8 | ↓ |