In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 16th, 2011 | 16 | Yes |
Popular Name: (2S)-2-(4-tetrahydropyran-4-ylpiperazin-1-yl)propan-1-amine (2S)-2-(4-tetrahydropyran-4-ylpi…
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) | -0.26 | 1.77 | -98.63 | 4 | 4 | 2 | 45 | 229.368 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.26 | -0.43 | -42.52 | 3 | 4 | 1 | 43 | 228.36 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.