In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-N-(2-hydroxyethyl)-N-(1-methyl-4-piperidyl)-2-phenyl-acetamide (2S)-2-amino-N-(2-hydroxyethyl)-…
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) | -1.43 | 3.29 | -36.53 | 4 | 5 | 1 | 71 | 292.403 | 5 | ↓ |
Mid Mid (pH 6-8) | -1.43 | 3.63 | -85.89 | 5 | 5 | 2 | 73 | 293.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.