In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 28 | 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) | 3.11 | 8.43 | -9.55 | 0 | 5 | 0 | 42 | 380.488 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 10.7 | -38.81 | 1 | 5 | 1 | 43 | 381.496 | 7 | ↓ |