In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2010 | 28 | 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) | 2.08 | 7.65 | -15.15 | 1 | 7 | 0 | 70 | 387.459 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 9.82 | -58.33 | 2 | 7 | 1 | 72 | 388.467 | 5 | ↓ |