In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 32 | 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) | 0.90 | 6.37 | -46.68 | 0 | 10 | -1 | 132 | 437.432 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 8.69 | -65.99 | 1 | 10 | 0 | 133 | 438.44 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.90 | 7.4 | -66.29 | 2 | 10 | 1 | 130 | 439.448 | 7 | ↓ |