In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: (2R)-N-[(1R)-1,2-bis(2-thienyl)ethyl]-2-ethyl-hexan-1-amine (2R)-N-[(1R)-1,2-bis(2-thienyl)e…
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) | 6.47 | 12.12 | -31.92 | 2 | 1 | 1 | 17 | 322.563 | 10 | ↓ |
Hi High (pH 8-9.5) | 6.47 | 10.99 | -1.88 | 1 | 1 | 0 | 12 | 321.555 | 10 | ↓ |