In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 18 | Yes |
Popular Name: [1-(4-isopropylpiperazin-1-yl)-4-methyl-cyclohexyl]methanamine [1-(4-isopropylpiperazin-1-yl)-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) | 1.46 | 5.93 | -102.8 | 4 | 3 | 2 | 35 | 255.45 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 3.71 | -43.77 | 3 | 3 | 1 | 34 | 254.442 | 3 | ↓ |