In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2009 | 24 | 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) | -3.81 | -2.46 | -257.01 | 2 | 13 | -3 | 206 | 385.138 | 6 | ↓ |
Mid Mid (pH 6-8) | -3.81 | -3.62 | -136.98 | 3 | 13 | -2 | 203 | 386.146 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
ALOGPS_SOLUBILITY | 8.03e+00 g/l | DrugBank-experimental |