In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2010 | 20 | Yes |
Popular Name: (5S)-N-(2-imidazol-1-ylethyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide (5S)-N-(2-imidazol-1-ylethyl)-5-…
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) | 2.12 | 8.94 | -40.02 | 2 | 4 | 1 | 48 | 290.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.12 | 8.42 | -13.96 | 1 | 4 | 0 | 47 | 289.404 | 4 | ↓ |