In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2004 | 27 | 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) | 3.95 | 11.09 | -29.57 | 1 | 9 | 0 | 134 | 384.373 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.02 | 9.67 | -53.08 | 0 | 9 | -1 | 140 | 383.365 | 6 | ↓ |