In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 24 | Yes |
Popular Name: N-[3-(4-methylpiperazin-1-yl)propyl]-2-phenyl-triazole-4-carboxamide N-[3-(4-methylpiperazin-1-yl)pro…
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 | 4.73 | -40.92 | 2 | 7 | 1 | 67 | 329.428 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.75 | 2.36 | -8.67 | 1 | 7 | 0 | 66 | 328.42 | 6 | ↓ |