In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 20 | 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) | 2.50 | 8.87 | -39.8 | 1 | 4 | 1 | 31 | 272.372 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 6.44 | -8.13 | 0 | 4 | 0 | 30 | 271.364 | 5 | ↓ |