In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2006 | 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) | 3.42 | 10.85 | -16.32 | 1 | 6 | 0 | 80 | 366.465 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 11.26 | -29.21 | 2 | 6 | 1 | 81 | 367.473 | 7 | ↓ |