In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 16 | 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) | 1.19 | 2.64 | -48.21 | 1 | 5 | -1 | 86 | 266.657 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.19 | 2.7 | -108.08 | 0 | 5 | -2 | 88 | 265.649 | 4 | ↓ |