In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 30 | Yes |
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) | 2.38 | 6.2 | -13.86 | 2 | 8 | 0 | 91 | 416.522 | 6 | ↓ |
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) | 2.38 | 6.6 | -14.92 | 2 | 8 | 0 | 91 | 416.522 | 6 | ↓ |
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) | 2.38 | 6.21 | -14.08 | 2 | 8 | 0 | 91 | 416.522 | 6 | ↓ |
Popular Name: 1-[1-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-methyl-propyl]-3-phenyl-urea 1-[1-[4-(4-methoxyphenyl)piperaz…
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) | 3.55 | 7.44 | -10.95 | 2 | 7 | 0 | 74 | 410.518 | 6 | ↓ |
Popular Name: 1-[1-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-2-methyl-propyl]-3-phenyl-urea 1-[1-[4-(4-methoxyphenyl)piperaz…
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) | 3.55 | 7.24 | -11.11 | 2 | 7 | 0 | 74 | 410.518 | 6 | ↓ |
Popular Name: 3-(4-methoxyphenyl)-1-[1-[(4-methyl-1-piperidyl)carbonyl]cyclohexyl]-urea 3-(4-methoxyphenyl)-1-[1-[(4-met…
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) | 3.98 | -1.22 | -18.57 | 2 | 6 | 0 | 70 | 373.497 | 4 | ↓ |
Popular Name: 3-(4-methoxyphenyl)-1-[1-(4-methylpiperazine-1-carbonyl)cyclohexyl]urea 3-(4-methoxyphenyl)-1-[1-(4-meth…
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) | 2.72 | 5.1 | -19.78 | 2 | 7 | 0 | 74 | 374.485 | 4 | ↓ |
Popular Name: 3-(4-methoxyphenyl)-1-[1-(4-methylpiperazin-1-yl)carbonylcyclohexyl]-urea 3-(4-methoxyphenyl)-1-[1-(4-meth…
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) | 2.72 | -1.25 | -53.89 | 3 | 7 | 1 | 75 | 375.493 | 4 | ↓ |
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) | 2.38 | 6.27 | -14.86 | 2 | 8 | 0 | 91 | 416.522 | 6 | ↓ |