In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: N-[(1S)-1-(2-thienyl)propyl]-4-(trifluoromethyl)cyclohexanamine N-[(1S)-1-(2-thienyl)propyl]-4-(…
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) | 4.68 | 9.27 | -34.88 | 2 | 1 | 1 | 17 | 292.39 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.68 | 8.68 | -2.48 | 1 | 1 | 0 | 12 | 291.382 | 5 | ↓ |