In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2011 | 19 | 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) | 3.62 | 7.99 | -38.64 | 3 | 2 | 1 | 37 | 254.353 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 7.73 | -4.4 | 2 | 2 | 0 | 35 | 253.345 | 5 | ↓ |