In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 17 | 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) | 2.33 | 5.63 | -41.92 | 0 | 5 | -1 | 74 | 360.156 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 5.59 | -10.35 | 1 | 5 | 0 | 72 | 361.164 | 3 | ↓ |