In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2005 | 27 | 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) | 1.96 | -1.91 | -18.33 | 1 | 7 | 0 | 74 | 364.405 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.96 | -1.8 | -53.42 | 2 | 7 | 1 | 76 | 365.413 | 4 | ↓ |