In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 28 | 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) | 3.26 | 12.15 | -87.04 | 2 | 5 | 2 | 30 | 389.632 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.26 | 9.89 | -36.1 | 1 | 5 | 1 | 29 | 388.624 | 8 | ↓ |