In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 27 | 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) | 0.99 | 7.11 | -69.67 | 1 | 7 | 0 | 91 | 389.477 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.99 | 6.36 | -47.59 | 2 | 7 | 1 | 88 | 390.485 | 6 | ↓ |