In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2004 | 32 | 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) | 5.60 | 12.53 | -11.28 | 1 | 3 | 0 | 41 | 429.604 | 2 | ↓ |
Lo Low (pH 4.5-6) | 5.60 | 13.3 | -70.56 | 2 | 3 | 0 | 42 | 430.612 | 2 | ↓ |