In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1R)-1-(3,4-dimethylphenyl)-N-ethyl-2-[(2S)-2-methylpyrrolidin-1-yl]ethanamine (1R)-1-(3,4-dimethylphenyl)-N-et…
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) | 3.64 | 10.17 | -110.28 | 3 | 2 | 2 | 21 | 262.441 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.64 | 9.37 | -31.55 | 2 | 2 | 1 | 16 | 261.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.64 | 8 | -37.26 | 2 | 2 | 1 | 20 | 261.433 | 5 | ↓ |