| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2009 | 31 | 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) | -0.61 | -0.18 | -114.9 | 7 | 10 | -1 | 194 | 428.421 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.06 | -1.2 | -135.5 | 6 | 10 | -2 | 193 | 427.413 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.06 | -0.21 | -230.4 | 5 | 10 | -3 | 196 | 426.405 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.64 | -0.21 | -75.38 | 7 | 10 | 0 | 188 | 429.429 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.64 | 0.44 | -125.88 | 6 | 10 | -1 | 191 | 428.421 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.64 | 0.55 | -126.26 | 6 | 10 | -1 | 191 | 428.421 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.06 | 0.89 | -127.81 | 7 | 10 | -1 | 194 | 428.421 | 2 | ↓ |
