In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: 4-[(2S)-3-amino-2-methyl-propyl]-N-ethyl-piperazine-1-carboxamide 4-[(2S)-3-amino-2-methyl-propyl]…
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) | 0.36 | 2.78 | -114.45 | 5 | 5 | 2 | 64 | 230.356 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.36 | 0.97 | -52.05 | 4 | 5 | 1 | 63 | 229.348 | 4 | ↓ |