In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 21 | Yes |
Popular Name: 2-[[(1R,2S)-2-amino-1-(4-chlorophenyl)butyl]-methyl-amino]-N-cyclopropyl-acetamide 2-[[(1R,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 | 6.65 | -129.13 | 5 | 4 | 2 | 61 | 311.857 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 5.12 | -44.99 | 4 | 4 | 1 | 60 | 310.849 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 6.36 | -42.34 | 4 | 4 | 1 | 60 | 310.849 | 7 | ↓ |