In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2009 | 21 | Yes |
Popular Name: 1-[2-[(3-methyl-2-thienyl)methylamino]-2-oxo-ethyl]cycloheptanecarboxylic 1-[2-[(3-methyl-2-thienyl)methyl…
None
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) | 3.10 | 7.95 | -65.88 | 1 | 4 | -1 | 69 | 308.423 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.10 | 6.77 | -14.44 | 2 | 4 | 0 | 66 | 309.431 | 5 | ↓ |