In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 19 | 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) | 2.78 | 9.1 | -53.38 | 0 | 4 | -1 | 47 | 257.313 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.78 | 10.02 | -59.99 | 1 | 4 | 0 | 48 | 258.321 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.78 | 10.1 | -63.57 | 1 | 4 | 0 | 48 | 258.321 | 3 | ↓ |