In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: N-allyl-2-[4-[(2S)-2-aminopropanoyl]piperazin-1-yl]acetamide N-allyl-2-[4-[(2S)-2-aminopropan…
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) | -0.99 | -0.94 | -49.9 | 4 | 6 | 1 | 80 | 255.342 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.99 | -1.28 | -14.25 | 3 | 6 | 0 | 79 | 254.334 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.99 | 1.21 | -104.58 | 5 | 6 | 2 | 81 | 256.35 | 5 | ↓ |