In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 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) | 3.61 | 7.36 | -10.73 | 1 | 4 | 0 | 49 | 265.316 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.15 | 8.42 | -43.68 | 2 | 4 | 1 | 50 | 266.324 | 1 | ↓ |