In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 17 | Yes |
Popular Name: 2-methyl-N-[(1S)-1-(2,4,6-trimethylphenyl)ethyl]butan-2-amine 2-methyl-N-[(1S)-1-(2,4,6-trimet…
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) | 4.95 | 9.19 | -33.52 | 2 | 1 | 1 | 17 | 234.407 | 4 | ↓ |
Popular Name: 2-methyl-N-[(1R)-1-(2,4,6-trimethylphenyl)ethyl]butan-2-amine 2-methyl-N-[(1R)-1-(2,4,6-trimet…
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) | 4.95 | 9.11 | -33.48 | 2 | 1 | 1 | 17 | 234.407 | 4 | ↓ |
Popular Name: N-[(1S)-1-(2,4-dimethylphenyl)ethyl]-2-methyl-butan-2-amine N-[(1S)-1-(2,4-dimethylphenyl)et…
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) | 4.57 | 8.43 | -34.37 | 2 | 1 | 1 | 17 | 220.38 | 4 | ↓ |
Popular Name: N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-methyl-butan-2-amine N-[(1R)-1-(2,4-dimethylphenyl)et…
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) | 4.57 | 8.46 | -34.34 | 2 | 1 | 1 | 17 | 220.38 | 4 | ↓ |