In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 2-[4-[2-(cyclopropylmethylamino)acetyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide 2-[4-[2-(cyclopropylmethylamino)…
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) | -0.96 | 6.79 | -102.76 | 3 | 6 | 2 | 62 | 298.431 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.96 | 5.05 | -49.86 | 2 | 6 | 1 | 60 | 297.423 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.96 | 5.42 | -43.43 | 2 | 6 | 1 | 57 | 297.423 | 6 | ↓ |