| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2005 | 17 | 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) | -1.72 | -5.02 | -11.17 | 3 | 7 | 0 | 105 | 246.194 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.26 | -7.78 | -48.69 | 2 | 7 | -1 | 108 | 245.186 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Therapy | antineoplastic, antimetabolite | SMDC Pharmakon |
