In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 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) | 2.28 | 4.93 | -3.01 | 0 | 2 | 0 | 12 | 205.301 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.28 | 7.12 | -32.43 | 1 | 2 | 1 | 14 | 206.309 | 2 | ↓ |