In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 18 | Yes |
Popular Name: 2-[4-[(2S)-3-amino-2-methyl-propyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide 2-[4-[(2S)-3-amino-2-methyl-prop…
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) | -1.03 | 1.56 | -49.51 | 3 | 5 | 1 | 54 | 257.402 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.03 | 3.26 | -107.98 | 4 | 5 | 2 | 56 | 258.41 | 5 | ↓ |