In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 21 | 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) | 3.81 | 8.9 | -38.59 | 2 | 3 | 1 | 50 | 294.765 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.81 | 8.48 | -11.18 | 1 | 3 | 0 | 49 | 293.757 | 3 | ↓ |