In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 16 | Yes |
Popular Name: (1S)-1-[5-(5-bromo-2-thienyl)-1H-imidazol-2-yl]-2-methyl-propan-1-amine (1S)-1-[5-(5-bromo-2-thienyl)-1H…
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) | 1.03 | 5.32 | -49.22 | 4 | 3 | 1 | 56 | 301.233 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.03 | 5.07 | -5.59 | 3 | 3 | 0 | 55 | 300.225 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.03 | 5.23 | -118.85 | 5 | 3 | 2 | 58 | 302.241 | 3 | ↓ |