In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 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) | 3.03 | 8.53 | -57.14 | 1 | 5 | -1 | 78 | 312.773 | 10 | ↓ |
Lo Low (pH 4.5-6) | 3.03 | 6.55 | -19.5 | 2 | 5 | 0 | 76 | 313.781 | 10 | ↓ |