In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 26 | 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) | 4.03 | 10.88 | -47.62 | 3 | 4 | 1 | 55 | 355.502 | 10 | ↓ |
Hi High (pH 8-9.5) | 4.03 | 9.54 | -9.23 | 2 | 4 | 0 | 50 | 354.494 | 10 | ↓ |