In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 8th, 2006 | 26 | 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) | 3.80 | 10.76 | -10.6 | 1 | 4 | 0 | 45 | 361.47 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.80 | 11.1 | -38.93 | 2 | 4 | 1 | 46 | 362.478 | 4 | ↓ |