In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 20th, 2006 | 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) | 4.01 | -3.77 | -17.55 | 1 | 5 | 0 | 63 | 385.514 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.01 | -3.19 | -58.76 | 0 | 5 | -1 | 66 | 384.506 | 4 | ↓ |