In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 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) | 3.00 | 7.66 | -15.16 | 1 | 6 | 0 | 59 | 378.476 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.00 | 8.1 | -34.59 | 2 | 6 | 1 | 61 | 379.484 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 10.32 | -119.39 | 3 | 6 | 2 | 62 | 380.492 | 5 | ↓ |