In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: 4-[(1R)-3-amino-1-ethyl-propyl]-1,4-diazepane-1-carboxamide 4-[(1R)-3-amino-1-ethyl-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) | -0.28 | 1.76 | -115.03 | 6 | 5 | 2 | 78 | 230.356 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.28 | 1.37 | -42.6 | 5 | 5 | 1 | 77 | 229.348 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.28 | 0.28 | -48.57 | 5 | 5 | 1 | 77 | 229.348 | 4 | ↓ |