In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 15 | 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) | 2.43 | 6.8 | -42.81 | 0 | 2 | -1 | 40 | 266.114 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 6.94 | -43.09 | 0 | 2 | -1 | 40 | 266.114 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 5.07 | -9.89 | 1 | 2 | 0 | 37 | 267.122 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 5.07 | -9.9 | 1 | 2 | 0 | 37 | 267.122 | 1 | ↓ |