In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2010 | 44 | 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) | -4.86 | -10.62 | -58.58 | 13 | 19 | 1 | 304 | 629.696 | 17 | ↓ |
Mid Mid (pH 6-8) | -4.86 | -10.95 | -24.11 | 12 | 19 | 0 | 302 | 628.688 | 17 | ↓ |