In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 15th, 2008 | 28 | Yes |
Popular Name: N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]-3-[(2-phenylacetyl)amino]propanamide N-[6-(4-methylpiperazin-1-yl)-3-…
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) | 1.56 | 6.85 | -56.27 | 3 | 7 | 1 | 79 | 382.488 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 7.14 | -114.92 | 4 | 7 | 2 | 80 | 383.496 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 4.38 | -25 | 2 | 7 | 0 | 78 | 381.48 | 7 | ↓ |