In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 20 | Yes |
Popular Name: N-[3-[(1R)-1-aminoethyl]phenyl]-4-ethyl-piperazine-1-carboxamide N-[3-[(1R)-1-aminoethyl]phenyl]-…
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) | -0.20 | 5.51 | -97.09 | 5 | 5 | 2 | 64 | 278.4 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.20 | 3.3 | -52.71 | 4 | 5 | 1 | 63 | 277.392 | 3 | ↓ |