In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: N-[[2-(4-isopropylpiperazin-1-yl)phenyl]methyl]propan-2-amine N-[[2-(4-isopropylpiperazin-1-yl…
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) | 2.79 | 9.96 | -91.89 | 3 | 3 | 2 | 24 | 277.456 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 7.76 | -33.82 | 2 | 3 | 1 | 23 | 276.448 | 5 | ↓ |