In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 30th, 2011 | 20 | Yes |
Popular Name: (2S)-N-ethyl-1-(4-isopropylphenyl)-3-(2-thienyl)propan-2-amine (2S)-N-ethyl-1-(4-isopropylpheny…
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) | 5.48 | 11.21 | -36.95 | 2 | 1 | 1 | 17 | 288.48 | 7 | ↓ |
Hi High (pH 8-9.5) | 5.48 | 9.99 | -2.73 | 1 | 1 | 0 | 12 | 287.472 | 7 | ↓ |