In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 27 | 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) | 3.44 | 8.61 | -49.08 | 3 | 6 | 1 | 76 | 389.545 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 6.44 | -14.44 | 2 | 6 | 0 | 74 | 388.537 | 7 | ↓ |