In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 27 | Yes |
Popular Name: 1-(3,4-dichlorophenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea 1-(3,4-dichlorophenyl)-3-[3-(4-p…
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) | 4.62 | 9.81 | -53.09 | 3 | 5 | 1 | 49 | 408.353 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 7.58 | -12.37 | 2 | 5 | 0 | 48 | 407.345 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.