In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 22 | Yes |
None
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) | 1.64 | 10 | -161.6 | 3 | 4 | 3 | 17 | 311.538 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.48 | -84.62 | 2 | 4 | 2 | 15 | 310.53 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.64 | 7.68 | -77.06 | 2 | 4 | 2 | 15 | 310.53 | 8 | ↓ |