In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(3-methoxyphenyl)methyl]-N-methyl-pentanamide (2S)-2-amino-N-[(3-methoxyphenyl…
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) | 1.40 | 4.45 | -42.73 | 3 | 4 | 1 | 57 | 251.35 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 4.12 | -8.65 | 2 | 4 | 0 | 56 | 250.342 | 6 | ↓ |