In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | 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) | 2.03 | 8.99 | -48.44 | 0 | 5 | -1 | 80 | 280.307 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.03 | 9.4 | -66.22 | 1 | 5 | 0 | 81 | 281.315 | 2 | ↓ |