In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 21 | Yes |
Popular Name: 2-[[(1S,2S)-2-amino-1-(4-chlorophenyl)butyl]-methyl-amino]-N-cyclopropyl-acetamide 2-[[(1S,2S)-2-amino-1-(4-chlorop…
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) | 2.32 | 6.37 | -125.06 | 5 | 4 | 2 | 61 | 311.857 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 4.98 | -50.24 | 4 | 4 | 1 | 60 | 310.849 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 6.06 | -39.72 | 4 | 4 | 1 | 60 | 310.849 | 7 | ↓ |