In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2010 | 31 | 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) | 1.87 | 8.43 | -51.86 | 1 | 10 | -1 | 131 | 440.509 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 9.83 | -20.64 | 2 | 10 | 0 | 128 | 441.517 | 5 | ↓ |