In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 40 | 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) | -5.40 | -14.28 | -165.71 | 20 | 19 | 3 | 343 | 586.62 | 11 | ↓ |
Mid Mid (pH 6-8) | -5.40 | -15.48 | -100.6 | 19 | 19 | 2 | 338 | 585.612 | 11 | ↓ |