In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 21 | No |
Popular Name: N-[(3S)-1,1-dioxothian-3-yl]-6-(propylamino)pyridazine-3-carboxamide N-[(3S)-1,1-dioxothian-3-yl]-6-(…
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) | 0.32 | 0.73 | -16.72 | 2 | 7 | 0 | 101 | 312.395 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 0.89 | -44.12 | 3 | 7 | 1 | 102 | 313.403 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.32 | 0.96 | -43.95 | 3 | 7 | 1 | 102 | 313.403 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.