In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 19 | 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) | 2.46 | 8.15 | -16.55 | 0 | 5 | 0 | 76 | 254.245 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.46 | 2.12 | -53.65 | 1 | 5 | 1 | 77 | 255.253 | 4 | ↓ |