In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 27 | No |
Popular Name: (2Z)-7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-2-(4-pyridylmethylene)benzofuran-3-one (2Z)-7-[(4-ethylpiperazin-1-yl)m…
None
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) | 1.91 | 6.64 | -27.1 | 1 | 6 | 0 | 74 | 365.433 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.91 | 4.31 | -41.23 | 0 | 6 | -1 | 73 | 364.425 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 5.89 | -43.27 | 2 | 6 | 1 | 71 | 366.441 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 6.69 | -51.06 | 1 | 6 | 0 | 74 | 365.433 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 3.62 | -8.46 | 1 | 6 | 0 | 70 | 365.433 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.91 | 5.84 | -44.3 | 2 | 6 | 1 | 71 | 366.441 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.91 | 6.3 | -98.35 | 3 | 6 | 2 | 72 | 367.449 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.91 | 6.36 | -98.75 | 3 | 6 | 2 | 72 | 367.449 | 4 | ↓ |