In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 19 | 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) | 1.15 | 4.84 | -41.11 | 2 | 5 | 1 | 57 | 268.381 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.15 | 3.7 | -15.87 | 1 | 5 | 0 | 53 | 267.373 | 3 | ↓ |