In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 29 | 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) | 3.45 | 2.09 | -45.17 | 2 | 6 | 1 | 75 | 397.495 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.86 | 1.89 | -53.23 | 1 | 6 | 1 | 72 | 397.495 | 8 | ↓ |