In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-N1-ethyl-N2-[(2-methoxyphenyl)methyl]-N2-methyl-cyclopentane-1,2-diamine (1S,2S)-N1-ethyl-N2-[(2-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) | 2.79 | 8.35 | -108.05 | 3 | 3 | 2 | 30 | 264.413 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 6.09 | -37.64 | 2 | 3 | 1 | 29 | 263.405 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 7.24 | -28.03 | 2 | 3 | 1 | 26 | 263.405 | 6 | ↓ |