In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2008 | 28 | Yes |
Popular Name: (1S,2R)-2-[2-(4-methoxy-3-pentoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1S,2R)-2-[2-(4-methoxy-3-pentox…
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) | 4.21 | -0.13 | -64.65 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1S,2S)-2-[2-(4-methoxy-3-pentoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1S,2S)-2-[2-(4-methoxy-3-pentox…
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) | 4.21 | 0.05 | -65.72 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1R,2R)-2-[2-(4-methoxy-3-pentoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1R,2R)-2-[2-(4-methoxy-3-pentox…
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) | 4.21 | 0.05 | -65.71 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1R,2S)-2-[2-(4-methoxy-3-pentoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1R,2S)-2-[2-(4-methoxy-3-pentox…
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) | 4.21 | -0.14 | -64.67 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1S,2R)-2-[2-(3-butoxy-4-methoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1S,2R)-2-[2-(3-butoxy-4-methoxy…
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) | 3.71 | -0.25 | -64.75 | 1 | 6 | -1 | 88 | 376.473 | 10 | ↓ |
Popular Name: (1S,2R)-2-[2-(4-butoxy-3-ethoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1S,2R)-2-[2-(4-butoxy-3-ethoxy-…
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) | 4.08 | -0.24 | -64.73 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1S,2S)-2-[2-(4-butoxy-3-ethoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1S,2S)-2-[2-(4-butoxy-3-ethoxy-…
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) | 4.08 | -0.06 | -65.71 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1R,2R)-2-[2-(4-butoxy-3-ethoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1R,2R)-2-[2-(4-butoxy-3-ethoxy-…
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) | 4.08 | -0.06 | -65.7 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |
Popular Name: (1R,2S)-2-[2-(4-butoxy-3-ethoxy-phenyl)ethylcarbamoyl]cyclohexane-1-carboxylic (1R,2S)-2-[2-(4-butoxy-3-ethoxy-…
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) | 4.08 | -0.24 | -64.77 | 1 | 6 | -1 | 88 | 390.5 | 11 | ↓ |