In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2010 | 16 | Yes |
Popular Name: (1R,2S)-N1-(1-ethylpropyl)-N1-(2-methoxyethyl)cyclopentane-1,2-diamine (1R,2S)-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) | 1.83 | 4.46 | -38.86 | 3 | 3 | 1 | 40 | 229.388 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 4.14 | -0.12 | 2 | 3 | 0 | 38 | 228.38 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.83 | 5.49 | -23.2 | 3 | 3 | 1 | 40 | 229.388 | 7 | ↓ |