In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2010 | 25 | No |
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) | 1.38 | 4.81 | -14.71 | 1 | 6 | 0 | 62 | 369.531 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.38 | 6.44 | -46.17 | 2 | 6 | 1 | 63 | 370.539 | 4 | ↓ |