In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 21 | Yes |
Popular Name: 3-amino-N,1-diethyl-N-(4-pyridylmethyl)pyrazole-4-sulfonamide 3-amino-N,1-diethyl-N-(4-pyridyl…
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) | 0.10 | 2.9 | -14.05 | 2 | 7 | 0 | 94 | 309.395 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.10 | 3.35 | -44.87 | 3 | 7 | 1 | 95 | 310.403 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.