In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 2-[4-[(2R)-2-amino-4-methyl-pentanoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide 2-[4-[(2R)-2-amino-4-methyl-pent…
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) | -0.75 | 4.97 | -100.43 | 4 | 6 | 2 | 73 | 300.447 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.75 | 3.1 | -9.76 | 2 | 6 | 0 | 70 | 298.431 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.75 | 4.64 | -39.17 | 3 | 6 | 1 | 71 | 299.439 | 5 | ↓ |