In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 21 | Yes |
Popular Name: (1S,2S)-1-(5-methyl-2-thienyl)-1-[(2R)-2-phenylpyrrolidin-1-yl]propan-2-amine (1S,2S)-1-(5-methyl-2-thienyl)-1…
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) | 3.24 | 9.79 | -111.5 | 4 | 2 | 2 | 32 | 302.487 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.24 | 7.56 | -2.74 | 2 | 2 | 0 | 29 | 300.471 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.23 | -37.77 | 3 | 2 | 1 | 31 | 301.479 | 4 | ↓ |