In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 27 | Yes |
Popular Name: (2S)-N-[(3,5-dimethoxyphenyl)methyl]-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethanamine (2S)-N-[(3,5-dimethoxyphenyl)met…
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) | 3.61 | 7.9 | -40.11 | 2 | 5 | 1 | 44 | 371.501 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 5.37 | -6.42 | 1 | 5 | 0 | 43 | 370.493 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.61 | 6.74 | -46.24 | 2 | 5 | 1 | 48 | 371.501 | 9 | ↓ |