In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 18 | Yes |
Popular Name: N-[[4-(3-aminoprop-1-ynyl)phenyl]methyl]-2-methoxy-N-methyl-acetamide N-[[4-(3-aminoprop-1-ynyl)phenyl…
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) | 0.05 | 5.32 | -54.48 | 3 | 4 | 1 | 57 | 247.318 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.05 | 4.91 | -14.42 | 2 | 4 | 0 | 56 | 246.31 | 4 | ↓ |