In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
Popular Name: N-[[5-(4-tert-butylphenyl)-2-thienyl]methyl]propan-2-amine N-[[5-(4-tert-butylphenyl)-2-thi…
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) | 5.69 | 10.97 | -36.83 | 2 | 1 | 1 | 17 | 288.48 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.69 | 9.76 | -2.72 | 1 | 1 | 0 | 12 | 287.472 | 5 | ↓ |