In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 17 | Yes |
Popular Name: (1R,2R)-N2-(2-methoxyethyl)-N2-methyl-N1-propyl-cycloheptane-1,2-diamine (1R,2R)-N2-(2-methoxyethyl)-N2-m…
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) | 2.88 | 5.61 | -33.02 | 2 | 3 | 1 | 29 | 243.415 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 4.65 | -1.02 | 1 | 3 | 0 | 24 | 242.407 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 6.22 | -28.45 | 2 | 3 | 1 | 26 | 243.415 | 7 | ↓ |