In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 20 | 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) | 4.75 | 9.95 | -46.6 | 0 | 2 | -1 | 40 | 263.316 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.59 | 4.2 | -14.43 | 0 | 2 | 0 | 34 | 264.324 | 1 | ↓ |