In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 2009 | 30 | Yes |
Popular Name: (2S)-1-[2-(1H-indol-3-yl)ethyl]-N-(2-naphthylmethyl)pyrrolidine-2-carboxamide (2S)-1-[2-(1H-indol-3-yl)ethyl]-…
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) | 4.38 | 12.85 | -42.66 | 3 | 4 | 1 | 49 | 398.53 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.38 | 10.59 | -16.45 | 2 | 4 | 0 | 48 | 397.522 | 6 | ↓ |