In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 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) | 1.98 | 5.04 | -78.79 | 4 | 6 | 2 | 63 | 381.561 | 11 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 2.76 | -40.6 | 3 | 6 | 1 | 62 | 380.553 | 11 | ↓ |