In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 11 | 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) | 0.91 | 3.68 | -124.95 | 0 | 3 | -2 | 63 | 156.181 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 2.81 | -47.93 | 1 | 3 | -1 | 60 | 157.189 | 3 | ↓ |