In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2010 | 19 | 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) | 3.11 | 8.26 | -7.53 | 0 | 3 | 0 | 30 | 261.365 | 5 | ↓ |
Popular Name: N-[(1R)-4-(diethylamino)-1-methyl-butyl]-N-[(4-ethoxyphenyl)methyl]naphthalene-2-carboxamide N-[(1R)-4-(diethylamino)-1-methy…
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) | 5.57 | 15.88 | -53.99 | 1 | 4 | 1 | 34 | 447.643 | 12 | ↓ |
Popular Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-N-[(4-ethoxyphenyl)methyl]naphthalene-2-carboxamide N-[(1S)-4-(diethylamino)-1-methy…
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) | 5.57 | 16.46 | -52.8 | 1 | 4 | 1 | 34 | 447.643 | 12 | ↓ |
Popular Name: 2-chloro-N-cyclopentyl-N-[(4-ethoxyphenyl)methyl]acetamide 2-chloro-N-cyclopentyl-N-[(4-eth…
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) | 3.50 | 9.14 | -10.61 | 0 | 3 | 0 | 30 | 295.81 | 6 | ↓ |
Popular Name: N-[(1R)-4-(diethylamino)-1-methyl-butyl]-N-[(4-ethoxyphenyl)methyl]-4-methoxy-benzamide N-[(1R)-4-(diethylamino)-1-methy…
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) | 4.45 | 12.9 | -47.74 | 1 | 5 | 1 | 43 | 427.609 | 13 | ↓ |
Popular Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-N-[(4-ethoxyphenyl)methyl]-4-methoxy-benzamide N-[(1S)-4-(diethylamino)-1-methy…
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) | 4.45 | 13.63 | -41.71 | 1 | 5 | 1 | 43 | 427.609 | 13 | ↓ |
Popular Name: N-[(1R)-4-(diethylamino)-1-methyl-butyl]-N-[(4-ethoxyphenyl)methyl]naphthalene-1-carboxamide N-[(1R)-4-(diethylamino)-1-methy…
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) | 5.55 | 16.66 | -45.16 | 1 | 4 | 1 | 34 | 447.643 | 12 | ↓ |
Popular Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-N-[(4-ethoxyphenyl)methyl]naphthalene-1-carboxamide N-[(1S)-4-(diethylamino)-1-methy…
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) | 5.55 | 16.33 | -34.78 | 1 | 4 | 1 | 34 | 447.643 | 12 | ↓ |