In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2008 | 29 | 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) | 1.50 | 8.6 | -56.35 | 1 | 7 | 1 | 61 | 402.494 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.50 | 6.45 | -13.11 | 0 | 7 | 0 | 59 | 401.486 | 3 | ↓ |