In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2010 | 14 | Yes |
Popular Name: (2S)-N1-[(1S)-1-cyclopropylethyl]-N1-(2-methoxyethyl)propane-1,2-diamine (2S)-N1-[(1S)-1-cyclopropylethyl…
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) | 0.73 | 2.5 | -37.38 | 3 | 3 | 1 | 40 | 201.334 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.73 | 4.42 | -113.64 | 4 | 3 | 2 | 41 | 202.342 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.73 | 3.61 | -27.08 | 3 | 3 | 1 | 40 | 201.334 | 7 | ↓ |