In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: 1-tert-butyl-4-[[(2S)-pyrrolidin-2-yl]methyl]piperazine 1-tert-butyl-4-[[(2S)-pyrrolidin…
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) | 1.59 | 5.12 | -85.45 | 3 | 3 | 2 | 24 | 227.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.59 | 2.99 | -32.56 | 2 | 3 | 1 | 23 | 226.388 | 3 | ↓ |