In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 20 | Yes |
Popular Name: (1S,2S)-2-(4-isopropylpiperazin-1-yl)-1-(p-tolyl)propan-1-ol (1S,2S)-2-(4-isopropylpiperazin-…
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) | 2.50 | 6.31 | -33.28 | 2 | 3 | 1 | 28 | 277.432 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 4.08 | -3.21 | 1 | 3 | 0 | 27 | 276.424 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.50 | 5.85 | -32.2 | 2 | 3 | 1 | 28 | 277.432 | 4 | ↓ |