In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 27 | Yes |
Popular Name: 1-[(1S)-2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-phenyl-urea 1-[(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) | 2.42 | 6.29 | -10.23 | 2 | 6 | 0 | 65 | 366.465 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.42 | 8.5 | -49.56 | 3 | 6 | 1 | 66 | 367.473 | 5 | ↓ |