In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 35 | 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) | 6.06 | 9.99 | -47.5 | 0 | 7 | -1 | 81 | 509.991 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.06 | 10.81 | -15.18 | 1 | 7 | 0 | 79 | 510.999 | 9 | ↓ |