In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(1R)-1-(4-tert-butylphenyl)ethyl]propanamide (2S)-2-amino-N-[(1R)-1-(4-tert-b…
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) | 2.29 | 4.79 | -43.09 | 4 | 3 | 1 | 57 | 249.378 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 4.47 | -5.99 | 3 | 3 | 0 | 55 | 248.37 | 4 | ↓ |