In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (3S)-3-amino-N-[[(1S,2R)-2-methylcyclohexyl]methyl]-3-phenyl-propanamide (3S)-3-amino-N-[[(1S,2R)-2-methy…
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) | 1.33 | 6.21 | -39.73 | 4 | 3 | 1 | 57 | 275.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.33 | 5.88 | -6.08 | 3 | 3 | 0 | 55 | 274.408 | 5 | ↓ |