In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 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) | 1.72 | 9.06 | -16.24 | 1 | 5 | 0 | 60 | 278.315 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 9.53 | -32.29 | 2 | 5 | 1 | 61 | 279.323 | 3 | ↓ |