In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 26 | Yes |
Popular Name: 1-(2,6-dimethylphenyl)-3-[(1R)-1-(4-ethylpiperazine-1-carbonyl)-2-methyl-propyl]urea 1-(2,6-dimethylphenyl)-3-[(1R)-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) | 2.04 | 5.87 | -7.81 | 2 | 6 | 0 | 65 | 360.502 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.04 | 8.07 | -44.53 | 3 | 6 | 1 | 66 | 361.51 | 5 | ↓ |