In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2008 | 26 | Yes |
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) | 0.62 | 8.76 | -33.96 | 1 | 7 | 1 | 65 | 358.466 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 7.87 | -83.17 | 2 | 7 | 2 | 66 | 359.474 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 8.4 | -10.24 | 0 | 7 | 0 | 63 | 357.458 | 5 | ↓ |