In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 20th, 2006 | 30 | 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) | 1.24 | 2.53 | -13.91 | 3 | 9 | 0 | 128 | 405.414 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 2.99 | -39.97 | 4 | 9 | 1 | 130 | 406.422 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 2.17 | -60.05 | 4 | 9 | 1 | 130 | 406.422 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.24 | 2.33 | -42.05 | 4 | 9 | 1 | 130 | 406.422 | 5 | ↓ |