In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 18 | Yes |
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) | 2.11 | 2.53 | -39.18 | 4 | 4 | 1 | 63 | 256.414 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 4.87 | -106.02 | 5 | 4 | 2 | 64 | 257.422 | 8 | ↓ |