In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 34 | 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) | -5.51 | -4.71 | -156.21 | 13 | 17 | 0 | 311 | 490.474 | 16 | ↓ |
Mid Mid (pH 6-8) | -5.51 | -5.14 | -124.65 | 12 | 17 | -1 | 309 | 489.466 | 16 | ↓ |
Lo Low (pH 4.5-6) | -5.51 | -6.73 | -132.8 | 14 | 17 | 1 | 308 | 491.482 | 16 | ↓ |