| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 17 | No |
Popular Name: CHEBI:1080; CHEBI:19557 CHEBI:1080; CHEBI:19557
| 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) | -2.85 | -2.99 | -338.97 | 1 | 10 | -4 | 174 | 290.057 | 5 | ↓ |
| Mid Mid (pH 6-8) | -2.85 | -4.14 | -217.52 | 2 | 10 | -3 | 171 | 291.065 | 5 | ↓ |
| Mid Mid (pH 6-8) | -2.85 | -4.15 | -214.06 | 2 | 10 | -3 | 171 | 291.065 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -2.85 | -5.29 | -107.72 | 3 | 10 | -2 | 169 | 292.073 | 5 | ↓ |
