In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 14 | Yes |
Popular Name: N-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylmethyl)ethanamine N-(5,6,7,8-tetrahydro-4H-cyclohe…
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) | 3.45 | 7.51 | -36.05 | 2 | 1 | 1 | 17 | 210.366 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 6.14 | -2.01 | 1 | 1 | 0 | 12 | 209.358 | 3 | ↓ |