In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2008 | 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) | 2.75 | 7.15 | -48.33 | 2 | 6 | 1 | 63 | 367.473 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 4.71 | -10.29 | 1 | 6 | 0 | 62 | 366.465 | 4 | ↓ |