In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 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) | 0.62 | 9.23 | -27.85 | 2 | 7 | 0 | 103 | 394.427 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 8.09 | -51.04 | 1 | 7 | -1 | 99 | 393.419 | 4 | ↓ |