In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 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) | 1.01 | 4.27 | -47.88 | 3 | 5 | 1 | 64 | 314.207 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 2.05 | -10.88 | 2 | 5 | 0 | 62 | 313.199 | 4 | ↓ |