In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(4-isopropylphenyl)-2-(4-isopropylpiperazin-1-yl)ethanol (1S)-1-(4-isopropylphenyl)-2-(4-…
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) | 3.23 | 6.76 | -32.11 | 2 | 3 | 1 | 28 | 291.459 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.23 | 4.55 | -3.57 | 1 | 3 | 0 | 27 | 290.451 | 5 | ↓ |