In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 16th, 2011 | 27 | 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) | 1.20 | 9.45 | -51.89 | 1 | 6 | 1 | 54 | 374.505 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 7.24 | -18.95 | 0 | 6 | 0 | 53 | 373.497 | 7 | ↓ |