In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | No |
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) | 3.18 | -2.16 | -6.1 | 2 | 2 | 0 | 38 | 302.14 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.18 | -2.03 | -26.45 | 3 | 2 | 1 | 40 | 303.148 | 1 | ↓ |