In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 31 | Yes |
Popular Name: (2S)-2-acetamido-3-(1H-indol-3-yl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]propanamide (2S)-2-acetamido-3-(1H-indol-3-y…
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) | 1.05 | 3.79 | -29.35 | 4 | 9 | 0 | 119 | 420.473 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.05 | 4.04 | -63.06 | 5 | 9 | 1 | 120 | 421.481 | 6 | ↓ |