In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 33 | Yes |
Popular Name: 1-[(1S)-1-(4-benzylpiperazine-1-carbonyl)-2-methyl-propyl]-3-(2,4-dimethoxyphenyl)urea 1-[(1S)-1-(4-benzylpiperazine-1-…
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) | 3.24 | 5.91 | -9.98 | 2 | 8 | 0 | 83 | 454.571 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 8.46 | -50.32 | 3 | 8 | 1 | 84 | 455.579 | 8 | ↓ |