In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 22nd, 2012 | 16 | Yes |
Popular Name: 4,4-dimethyl-N-[(1S)-1-(2-thienyl)ethyl]cyclohexanamine 4,4-dimethyl-N-[(1S)-1-(2-thieny…
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) | 4.04 | 8.2 | -34.92 | 2 | 1 | 1 | 17 | 238.42 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.04 | 7.18 | -1.18 | 1 | 1 | 0 | 12 | 237.412 | 3 | ↓ |