In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-N1-ethyl-N2-[(4-methoxyphenyl)methyl]-N2-methyl-cyclopentane-1,2-diamine (1S,2R)-N1-ethyl-N2-[(4-methoxyp…
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) | 2.84 | 8.74 | -112.79 | 3 | 3 | 2 | 30 | 264.413 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 7.13 | -33.92 | 2 | 3 | 1 | 29 | 263.405 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 8.72 | -33.25 | 2 | 3 | 1 | 26 | 263.405 | 6 | ↓ |