In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 26 | 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) | 6.53 | 7.23 | -43.08 | 0 | 5 | -1 | 70 | 492.172 | 1 | ↓ |
Ref Reference (pH 7) | 6.53 | 7.92 | -41.43 | 0 | 5 | -1 | 70 | 492.172 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.07 | 9.06 | -8.2 | 1 | 5 | 0 | 67 | 493.18 | 1 | ↓ |
Mid Mid (pH 6-8) | 6.07 | 9.49 | -7.9 | 1 | 5 | 0 | 67 | 493.18 | 1 | ↓ |