In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 16 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(4-bromo-2-thienyl)ethyl]-methyl-amino]-N-methyl-acetamide 2-[[(1R)-2-amino-1-(4-bromo-2-th…
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) | 0.97 | 1.15 | -46.99 | 4 | 4 | 1 | 60 | 307.237 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.97 | -0.05 | -9.66 | 3 | 4 | 0 | 58 | 306.229 | 5 | ↓ |