In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 26 | 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) | 2.26 | 7.22 | -19.58 | 1 | 7 | 0 | 81 | 391.522 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 8.34 | -40.24 | 2 | 7 | 1 | 83 | 392.53 | 6 | ↓ |