In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2006 | 27 | 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) | 3.10 | 9.89 | -14.02 | 1 | 6 | 0 | 63 | 381.505 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 10.67 | -27.76 | 2 | 6 | 0 | 64 | 382.513 | 7 | ↓ |