In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2004 | 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) | 2.91 | 12.55 | -7.93 | 1 | 8 | 0 | 76 | 356.43 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 12.8 | -28.97 | 2 | 8 | 1 | 77 | 357.438 | 5 | ↓ |