In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 21 | Yes |
Popular Name: 3,5-dichloro-N-[(2S)-3-methyl-2-(4-methylpiperazin-1-yl)butyl]pyridin-2-amine 3,5-dichloro-N-[(2S)-3-methyl-2-…
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) | 3.38 | 7.15 | -32.51 | 2 | 4 | 1 | 33 | 332.299 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 4.63 | -2.06 | 1 | 4 | 0 | 31 | 331.291 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.38 | 7.04 | -35.5 | 2 | 4 | 1 | 33 | 332.299 | 5 | ↓ |