In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 19 | Yes |
Popular Name: (1S)-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]-1-(4-methylsulfanylphenyl)ethanamine (1S)-N-[[(2R)-1-ethylpyrrolidin-…
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) | 3.29 | 9.55 | -115.68 | 3 | 2 | 2 | 21 | 280.481 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 8.51 | -35.52 | 2 | 2 | 1 | 16 | 279.473 | 6 | ↓ |