In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 24 | 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) | -0.13 | 2.15 | -60.42 | 3 | 6 | 1 | 80 | 332.376 | 1 | ↓ |
Hi High (pH 8-9.5) | -0.13 | -0.1 | -16.04 | 2 | 6 | 0 | 79 | 331.368 | 1 | ↓ |