In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 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) | 1.95 | 10.76 | -61.55 | 0 | 9 | -1 | 132 | 430.396 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.95 | 9.88 | -20.85 | 1 | 9 | 0 | 129 | 431.404 | 7 | ↓ |