In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 20 | 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) | -1.33 | 4.9 | -47.24 | 3 | 6 | 1 | 71 | 303.452 | 9 | ↓ |
Hi High (pH 8-9.5) | -1.33 | 2.96 | -19.72 | 2 | 6 | 0 | 70 | 302.444 | 9 | ↓ |