In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2008 | 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) | 6.78 | 11.71 | -16.28 | 1 | 7 | 0 | 104 | 439.88 | 4 | ↓ |
Ref Reference (pH 7) | 6.29 | 11.26 | -46.66 | 0 | 7 | -1 | 103 | 438.872 | 5 | ↓ |