In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2006 | 34 | No |
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) | 2.98 | 2.26 | -55.99 | 2 | 10 | 1 | 126 | 468.486 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 2.53 | -63.75 | 1 | 10 | 1 | 123 | 468.486 | 9 | ↓ |