In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | No |
Popular Name: [(2S)-pyrrolidin-2-yl]-(1,4-thiazepan-4-yl)methanone [(2S)-pyrrolidin-2-yl]-(1,4-thia…
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) | 0.50 | 4.33 | -37.4 | 2 | 3 | 1 | 37 | 215.342 | 1 | ↓ |