In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 17 | 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) | 1.90 | 4.64 | -99.79 | 4 | 3 | 2 | 35 | 241.423 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 4.04 | -123.68 | 4 | 3 | 2 | 35 | 241.423 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 2.26 | -43.33 | 3 | 3 | 1 | 34 | 240.415 | 3 | ↓ |