In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 15th, 2005 | 25 | 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) | 3.88 | 11.17 | -44.41 | 2 | 3 | 1 | 33 | 348.495 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.88 | 8.95 | -9.6 | 1 | 3 | 0 | 32 | 347.487 | 3 | ↓ |