In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 26 | 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) | 2.60 | 6.1 | -46.38 | 2 | 6 | 1 | 67 | 350.398 | 3 | ↓ |
Ref Reference (pH 7) | 3.52 | 7.63 | -15.66 | 1 | 6 | 0 | 62 | 349.39 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 4.65 | -17.43 | 1 | 6 | 0 | 65 | 349.39 | 3 | ↓ |