In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2004 | 28 | 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) | 2.56 | 2.07 | -18.26 | 0 | 5 | 0 | 51 | 376.456 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.56 | 2.19 | -43.2 | 1 | 5 | 1 | 52 | 377.464 | 7 | ↓ |