In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2010 | 24 | Yes |
Popular Name: 4-[3-(4-isopropylpiperazin-1-yl)-3-oxo-propyl]-1,4-benzothiazin-3-one 4-[3-(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) | 1.79 | 7.06 | -10.63 | 0 | 5 | 0 | 44 | 347.484 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 9.2 | -46.23 | 1 | 5 | 1 | 45 | 348.492 | 4 | ↓ |