In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 20 | Yes |
Popular Name: (3S)-1-[(1R)-2-amino-1-(p-tolyl)ethyl]-N,N-diethyl-pyrrolidin-3-amine (3S)-1-[(1R)-2-amino-1-(p-tolyl)…
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) | 2.08 | 6.31 | -91.35 | 4 | 3 | 2 | 35 | 277.456 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 4.22 | -42.9 | 3 | 3 | 1 | 34 | 276.448 | 6 | ↓ |