In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2008 | 24 | 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) | 3.67 | 5.63 | -9.36 | 2 | 4 | 0 | 62 | 361.488 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.13 | 3.6 | -49.77 | 1 | 4 | -1 | 65 | 360.48 | 2 | ↓ |