In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 28 | Yes |
Popular Name: (3R)-N-(3-amino-3-oxo-propyl)-1-(1-phenethyl-4-piperidyl)piperidine-3-carboxamide (3R)-N-(3-amino-3-oxo-propyl)-1-…
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) | 1.45 | 5.5 | -49.23 | 4 | 6 | 1 | 80 | 387.548 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 5.56 | -51.45 | 4 | 6 | 1 | 80 | 387.548 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.45 | 7.76 | -120.63 | 5 | 6 | 2 | 81 | 388.556 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.