In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2005 | 19 | 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) | 4.45 | 11.01 | -25.64 | 1 | 2 | 1 | 19 | 253.369 | 1 | ↓ |
Mid Mid (pH 6-8) | 4.45 | 10.58 | -8.52 | 0 | 2 | 0 | 17 | 252.361 | 1 | ↓ |