In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2004 | 34 | 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) | 3.14 | 1.42 | -17.86 | 1 | 8 | 0 | 98 | 463.486 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 1.24 | -25.06 | 0 | 8 | 0 | 95 | 463.486 | 9 | ↓ |