In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2010 | 23 | Yes |
Popular Name: N-[(1R)-2-(4-isopropylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-methyl-benzamide N-[(1R)-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) | 1.80 | 5.36 | -8.57 | 1 | 5 | 0 | 53 | 317.433 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 7.52 | -42.41 | 2 | 5 | 1 | 54 | 318.441 | 4 | ↓ |