In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 18 | Yes |
Popular Name: 2-ethyl-1-[4-(ethylaminomethyl)-4-hydroxy-1-piperidyl]butan-1-one 2-ethyl-1-[4-(ethylaminomethyl)-…
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) | 1.43 | 4.13 | -54.9 | 3 | 4 | 1 | 57 | 257.398 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 3.01 | -8.94 | 2 | 4 | 0 | 53 | 256.39 | 6 | ↓ |