In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 18 | Yes |
Popular Name: 4-[[(1S)-1,3-dimethylbutyl]amino]-N,3-dimethyl-benzamide 4-[[(1S)-1,3-dimethylbutyl]amino…
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) | 4.01 | 6.06 | -9.05 | 2 | 3 | 0 | 41 | 248.37 | 5 | ↓ |
Popular Name: 4-[[(1S)-1,3-dimethylbutyl]amino]-N-ethyl-3-methyl-benzamide 4-[[(1S)-1,3-dimethylbutyl]amino…
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) | 4.39 | 6.88 | -8.62 | 2 | 3 | 0 | 41 | 262.397 | 6 | ↓ |
Popular Name: 4-[[(1R)-1,3-dimethylbutyl]amino]-N-ethyl-3-methyl-benzamide 4-[[(1R)-1,3-dimethylbutyl]amino…
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) | 4.39 | 6.91 | -8.64 | 2 | 3 | 0 | 41 | 262.397 | 6 | ↓ |
Popular Name: N-ethyl-3-methyl-4-[[(1R)-1-methylbutyl]amino]benzamide N-ethyl-3-methyl-4-[[(1R)-1-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) | 4.18 | 6.35 | -8.67 | 2 | 3 | 0 | 41 | 248.37 | 6 | ↓ |
Popular Name: N-ethyl-3-methyl-4-[[(1S)-1-methylbutyl]amino]benzamide N-ethyl-3-methyl-4-[[(1S)-1-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) | 4.18 | 6.36 | -8.66 | 2 | 3 | 0 | 41 | 248.37 | 6 | ↓ |