In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (1S,2S)-2-(4-tert-butylpiperazin-1-yl)-N-methyl-cyclooctanamine (1S,2S)-2-(4-tert-butylpiperazin…
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) | 3.60 | 8 | -92.39 | 3 | 3 | 2 | 24 | 283.504 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.60 | 5.87 | -33.79 | 2 | 3 | 1 | 23 | 282.496 | 3 | ↓ |