In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 14 | Yes |
Popular Name: (2R)-N1-cycloheptyl-N1,N2-dimethyl-propane-1,2-diamine (2R)-N1-cycloheptyl-N1,N2-dimeth…
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) | 2.87 | 6.83 | -111.03 | 3 | 2 | 2 | 21 | 200.37 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 3.26 | -0.58 | 1 | 2 | 0 | 15 | 198.354 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 4.97 | -32.05 | 2 | 2 | 1 | 20 | 199.362 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 5.69 | -28.65 | 2 | 2 | 1 | 16 | 199.362 | 4 | ↓ |