In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 34 | Yes |
Popular Name: N-[3-(4-cyclohexylpiperazin-1-yl)propyl]-3-methyl-4-(triazolo[5,4-b]pyridin-3-yl)benzamide N-[3-(4-cyclohexylpiperazin-1-yl…
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) | 3.61 | 10.18 | -51.79 | 2 | 8 | 1 | 80 | 462.622 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.61 | 7.91 | -16.86 | 1 | 8 | 0 | 79 | 461.614 | 7 | ↓ |