In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 7th, 2009 | 27 | 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) | 3.91 | 12.95 | -38.12 | 1 | 5 | 1 | 44 | 387.504 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.91 | 10.53 | -9.45 | 0 | 5 | 0 | 43 | 386.496 | 7 | ↓ |