In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2008 | 34 | 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) | 4.24 | 13 | -51.26 | 2 | 6 | 1 | 63 | 458.582 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.24 | 10.52 | -14.91 | 1 | 6 | 0 | 62 | 457.574 | 8 | ↓ |