In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 15 | 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) | 0.98 | 6.09 | -102.71 | 3 | 3 | 2 | 30 | 216.369 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 3.64 | -40.04 | 2 | 3 | 1 | 29 | 215.361 | 9 | ↓ |