In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 17 | No |
Popular Name: (3R)-N-[2-[(2S)-2-ethylpyrrolidin-1-yl]ethyl]-1,1-dioxo-thiolan-3-amine (3R)-N-[2-[(2S)-2-ethylpyrrolidi…
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) | 0.92 | 2.75 | -45.32 | 2 | 4 | 1 | 51 | 261.411 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 3.93 | -140.73 | 3 | 4 | 2 | 55 | 262.419 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.