In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 21 | Yes |
Popular Name: (2S,3S)-N-[(1S)-1-(1-adamantyl)ethyl]-2-amino-3-methyl-pentanamide (2S,3S)-N-[(1S)-1-(1-adamantyl)e…
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) | 3.17 | 6.76 | -45.56 | 4 | 3 | 1 | 57 | 293.475 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.17 | 6.49 | -5.76 | 3 | 3 | 0 | 55 | 292.467 | 5 | ↓ |