In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 26 | 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) | 3.60 | 12.4 | -27.21 | 2 | 3 | 0 | 57 | 345.442 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.60 | 11.53 | -49.44 | 1 | 3 | -1 | 52 | 344.434 | 7 | ↓ |