In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2009 | 20 | 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) | -0.95 | -3.08 | -60.1 | 5 | 9 | -1 | 140 | 298.304 | 2 | ↓ |
Mid Mid (pH 6-8) | -1.67 | -2.66 | -27.21 | 6 | 9 | 0 | 142 | 299.312 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
therap | antineoplastic | MicroSource Spectrum |