In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 29 | No |
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) | 3.52 | 9.24 | -8.86 | 0 | 5 | 0 | 58 | 388.467 | 3 | ↓ |
Ref Reference (pH 7) | 3.52 | 9.48 | -22.02 | 0 | 5 | 0 | 58 | 388.467 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 11.85 | -51.37 | 1 | 5 | 1 | 59 | 389.475 | 3 | ↓ |