In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2011 | 18 | Yes |
Popular Name: (1S,2S)-2-ethyl-1-(4-methylthiazol-2-yl)-N-propyl-cyclohexanamine (1S,2S)-2-ethyl-1-(4-methylthiaz…
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) | 4.17 | 7.44 | -30.57 | 2 | 2 | 1 | 29 | 267.462 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.17 | 6.24 | -4.72 | 1 | 2 | 0 | 25 | 266.454 | 5 | ↓ |