In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 19 | Yes |
Popular Name: (2S)-N-(4-amino-2-chloro-phenyl)-2-(2-cyanoethyl-methyl-amino)propanamide (2S)-N-(4-amino-2-chloro-phenyl)…
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) | 0.62 | 5.03 | -50.11 | 4 | 5 | 1 | 83 | 281.767 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 2.77 | -12.36 | 3 | 5 | 0 | 82 | 280.759 | 5 | ↓ |