In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 16th, 2010 | 17 | 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) | 1.04 | 3.9 | -46.15 | 2 | 3 | 1 | 37 | 241.261 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.04 | 2.53 | -10.18 | 1 | 3 | 0 | 32 | 240.253 | 3 | ↓ |