In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 21 | 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) | 4.03 | 8.83 | -34.43 | 2 | 2 | 1 | 16 | 303.392 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 9.95 | -124.95 | 3 | 2 | 2 | 21 | 304.4 | 7 | ↓ |