In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2006 | 12 | 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) | -1.13 | 0.53 | -50.59 | 6 | 5 | 1 | 91 | 168.224 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.13 | 1.03 | -88.23 | 7 | 5 | 2 | 93 | 169.232 | 4 | ↓ |