In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 32 | Yes |
Popular Name: 1-[2-(m-tolyl)pyrimidin-4-yl]-N-[(1S)-tetralin-1-yl]piperidine-4-carboxamide 1-[2-(m-tolyl)pyrimidin-4-yl]-N-…
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) | 4.12 | 13.82 | -16.3 | 1 | 5 | 0 | 58 | 426.564 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.12 | 14.17 | -39.07 | 2 | 5 | 1 | 59 | 427.572 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.