In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 27 | 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) | 5.27 | 0.98 | -12.96 | 1 | 3 | 0 | 38 | 359.469 | 8 | ↓ |
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) | 6.85 | 2.01 | -12.46 | 1 | 3 | 0 | 38 | 415.577 | 10 | ↓ |
Popular Name: N-benzhydryl-4-(4-isopropyl-3-methyl-phenoxy)butyramide N-benzhydryl-4-(4-isopropyl-3-me…
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) | 6.23 | 1.75 | -12.81 | 1 | 3 | 0 | 38 | 401.55 | 9 | ↓ |
Popular Name: 4-[4-(hydroxymethyl)-3-methoxy-phenoxy]-N-[phenyl-(p-tolyl)methyl]-butanamide 4-[4-(hydroxymethyl)-3-methoxy-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) | 4.59 | -1.31 | -14.94 | 2 | 5 | 0 | 67 | 419.521 | 10 | ↓ |
Popular Name: 4-[4-(hydroxymethyl)-3-methoxy-phenoxy]-N-[phenyl-(p-tolyl)methyl]-butanamide 4-[4-(hydroxymethyl)-3-methoxy-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) | 4.59 | -1.3 | -14.97 | 2 | 5 | 0 | 67 | 419.521 | 10 | ↓ |
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) | 5.22 | 1.06 | -12.79 | 1 | 3 | 0 | 38 | 359.469 | 8 | ↓ |
Popular Name: 4-(4-methylphenoxy)-N-[(S)-o-tolyl-phenyl-methyl]butanamide 4-(4-methylphenoxy)-N-[(S)-o-tol…
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) | 5.67 | 12.93 | -12.85 | 1 | 3 | 0 | 38 | 373.496 | 8 | ↓ |
Popular Name: 4-(4-methylphenoxy)-N-[(R)-o-tolyl-phenyl-methyl]butanamide 4-(4-methylphenoxy)-N-[(R)-o-tol…
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) | 5.67 | 12.79 | -11.61 | 1 | 3 | 0 | 38 | 373.496 | 8 | ↓ |
Popular Name: 4-(4-methoxyphenoxy)-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]butanamide 4-(4-methoxyphenoxy)-N-[(S)-(4-m…
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) | 4.93 | 10.35 | -17.42 | 1 | 5 | 0 | 57 | 405.494 | 10 | ↓ |
Popular Name: 4-(4-methoxyphenoxy)-N-[(R)-(4-methoxyphenyl)-phenyl-methyl]butanamide 4-(4-methoxyphenoxy)-N-[(R)-(4-m…
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) | 4.93 | 10.35 | -17.46 | 1 | 5 | 0 | 57 | 405.494 | 10 | ↓ |