In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2008 | 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) | 3.76 | 8.59 | -10.74 | 1 | 3 | 0 | 32 | 302.805 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.76 | 9.03 | -30.14 | 2 | 3 | 0 | 34 | 303.813 | 6 | ↓ |