In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: (1S)-N-[(1R)-1-(4-isopropylphenyl)ethyl]-1-(2-thienyl)propan-1-amine (1S)-N-[(1R)-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) | 5.93 | 11.31 | -33.09 | 2 | 1 | 1 | 17 | 288.48 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.93 | 10.49 | -1.98 | 1 | 1 | 0 | 12 | 287.472 | 6 | ↓ |