In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 20 | Yes |
Popular Name: 3-chloro-N-[(2S)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-2-amine 3-chloro-N-[(2S)-3-methyl-2-(4-m…
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) | 2.56 | 6.65 | -31.05 | 2 | 4 | 1 | 33 | 297.854 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 4.98 | -3.6 | 1 | 4 | 0 | 31 | 296.846 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 6.39 | -34.48 | 2 | 4 | 1 | 33 | 297.854 | 5 | ↓ |