In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 16 | 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) | 3.00 | 7.53 | -36.45 | 2 | 1 | 1 | 17 | 210.3 | 0 | ↓ |
Hi High (pH 8-9.5) | 3.00 | 6.17 | -2.82 | 1 | 1 | 0 | 12 | 209.292 | 0 | ↓ |