In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2009 | 28 | No |
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) | 4.06 | 7.28 | -48.1 | 2 | 4 | -1 | 81 | 389.556 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.06 | 5.3 | -10.15 | 3 | 4 | 0 | 78 | 390.564 | 4 | ↓ |