In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 27 | Yes |
Popular Name: N-[(1S)-2-(4-benzylpiperazin-1-yl)-1-methyl-ethyl]-3-phenyl-propanamide N-[(1S)-2-(4-benzylpiperazin-1-y…
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) | 3.39 | 10.55 | -42.94 | 2 | 4 | 1 | 37 | 366.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 10.64 | -44.29 | 2 | 4 | 1 | 37 | 366.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 8.3 | -8.36 | 1 | 4 | 0 | 36 | 365.521 | 8 | ↓ |