In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 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) | 3.99 | 12.05 | -44.19 | 2 | 6 | 1 | 64 | 390.577 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 10.09 | -12.02 | 1 | 6 | 0 | 63 | 389.569 | 10 | ↓ |