In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 25 | Yes |
Popular Name: 2-[[isopentyl-[(5-methyl-2-thienyl)methyl]amino]methyl]-N-propyl-thiazole-4-carboxamide 2-[[isopentyl-[(5-methyl-2-thien…
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) | 3.89 | 9.6 | -46.33 | 2 | 4 | 1 | 46 | 380.603 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 7.49 | -9.15 | 1 | 4 | 0 | 45 | 379.595 | 10 | ↓ |