In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2009 | 18 | 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) | -1.05 | 1.51 | -42.29 | 2 | 7 | -1 | 115 | 246.202 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.60 | -0.28 | -98.29 | 1 | 7 | -2 | 118 | 245.194 | 3 | ↓ |