In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2010 | 15 | 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) | 1.73 | 7.57 | -14.18 | 1 | 5 | 0 | 58 | 203.249 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.73 | 8.05 | -30.19 | 2 | 5 | 1 | 59 | 204.257 | 3 | ↓ |