In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2009 | 44 | 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 |
---|---|---|---|---|---|---|---|---|---|---|
Hi High (pH 8-9.5) | -5.66 | -5.4 | -118.04 | 18 | 19 | 1 | 358 | 627.728 | 20 | ↓ |
Hi High (pH 8-9.5) | -5.66 | -5.07 | -184.52 | 19 | 19 | 2 | 359 | 628.736 | 20 | ↓ |
Hi High (pH 8-9.5) | -5.66 | -4.22 | -164 | 19 | 19 | 2 | 362 | 628.736 | 20 | ↓ |
Mid Mid (pH 6-8) | -5.66 | -2.97 | -234.14 | 20 | 19 | 3 | 364 | 629.744 | 20 | ↓ |