In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2010 | 20 | Yes |
Popular Name: N-[(2S)-4-methyl-2-(4-methylpiperazin-1-yl)pentyl]pentanamide N-[(2S)-4-methyl-2-(4-methylpipe…
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) | 2.92 | 6.49 | -37.4 | 2 | 4 | 1 | 37 | 284.468 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 4.12 | -7.79 | 1 | 4 | 0 | 36 | 283.46 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 6.71 | -40.24 | 2 | 4 | 1 | 37 | 284.468 | 8 | ↓ |