In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2009 | 38 | 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) | -0.06 | 2.98 | -77.91 | 5 | 13 | -1 | 202 | 555.574 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.06 | 4 | -127.52 | 4 | 13 | -2 | 204 | 554.566 | 6 | ↓ |