In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: 4-[[(1R)-1-(5-bromo-2-thienyl)ethyl]amino]butanamide 4-[[(1R)-1-(5-bromo-2-thienyl)et…
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) | 2.16 | 3.21 | -47.16 | 4 | 3 | 1 | 60 | 292.222 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.16 | 2.04 | -10.01 | 3 | 3 | 0 | 55 | 291.214 | 6 | ↓ |