In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 19 | Yes |
Popular Name: (1R)-1-(4-isopropylphenyl)-N-[(1S)-1-(2-thienyl)ethyl]ethanamine (1R)-1-(4-isopropylphenyl)-N-[(1…
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) | 5.43 | 10.49 | -34.83 | 2 | 1 | 1 | 17 | 274.453 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.43 | 9.59 | -2.91 | 1 | 1 | 0 | 12 | 273.445 | 5 | ↓ |