In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 19 | Yes |
Popular Name: 4-[[2-[(5-chloro-2-thienyl)methyl-methyl-amino]-2-oxo-ethyl]amino]butanoic 4-[[2-[(5-chloro-2-thienyl)methy…
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) | 0.98 | 7.11 | -64.27 | 2 | 5 | 0 | 77 | 304.799 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 5.76 | -51.03 | 1 | 5 | -1 | 72 | 303.791 | 8 | ↓ |