In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2010 | 19 | Yes |
Popular Name: (1R,2R)-2-[1-ethylpropyl(methyl)amino]-1-(4-methoxyphenyl)propan-1-ol (1R,2R)-2-[1-ethylpropyl(methyl)…
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) | 3.29 | 6.15 | -31.9 | 2 | 3 | 1 | 34 | 266.405 | 7 | ↓ |
Popular Name: (1R,2R)-1-(4-methoxyphenyl)-2-(1-piperidyl)propan-1-ol (1R,2R)-1-(4-methoxyphenyl)-2-(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) | 2.45 | 5.67 | -33.92 | 2 | 3 | 1 | 34 | 250.362 | 4 | ↓ |
Popular Name: (1R,2S)-1-(4-methoxyphenyl)-2-(1-piperidyl)propan-1-ol (1R,2S)-1-(4-methoxyphenyl)-2-(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) | 2.45 | 5.84 | -35.09 | 2 | 3 | 1 | 34 | 250.362 | 4 | ↓ |
Popular Name: (1S,2R)-1-(4-methoxyphenyl)-2-(1-piperidyl)propan-1-ol (1S,2R)-1-(4-methoxyphenyl)-2-(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) | 2.45 | 5.78 | -35.04 | 2 | 3 | 1 | 34 | 250.362 | 4 | ↓ |
Popular Name: (1S,2S)-1-(4-methoxyphenyl)-2-(1-piperidyl)propan-1-ol (1S,2S)-1-(4-methoxyphenyl)-2-(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) | 2.45 | 5.67 | -33.88 | 2 | 3 | 1 | 34 | 250.362 | 4 | ↓ |
Popular Name: 2-{[2-hydroxy-2-(4-methoxyphenyl)-1-methylethyl]amino}-1-(4-methoxyphenyl)-1-propanol 2-{[2-hydroxy-2-(4-methoxyphenyl…
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) | 2.50 | -3.04 | -43.78 | 4 | 5 | 1 | 75 | 346.447 | 8 | ↓ |
Popular Name: 2-{[2-hydroxy-2-(4-methoxyphenyl)-1-methylethyl]amino}-1-(4-methoxyphenyl)-1-propanol 2-{[2-hydroxy-2-(4-methoxyphenyl…
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) | 2.50 | -3.74 | -46.56 | 4 | 5 | 1 | 75 | 346.447 | 8 | ↓ |
Popular Name: 2-{[2-hydroxy-2-(4-methoxyphenyl)-1-methylethyl]amino}-1-(4-methoxyphenyl)-1-propanol 2-{[2-hydroxy-2-(4-methoxyphenyl…
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) | 2.50 | -3.11 | -43.38 | 4 | 5 | 1 | 75 | 346.447 | 8 | ↓ |