In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2011 | 17 | Yes |
Popular Name: (3S)-1-(3-amino-4-methyl-phenyl)piperidine-3-carboxamide (3S)-1-(3-amino-4-methyl-phenyl)…
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) | 1.40 | 2.16 | -9.32 | 4 | 4 | 0 | 72 | 233.315 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 2.78 | -35.11 | 5 | 4 | 1 | 74 | 234.323 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.