In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | No |
Popular Name: N-(3-carbamothioylphenyl)-2-[(2R,6S)-2,6-dimethyl-1-piperidyl]acetamide N-(3-carbamothioylphenyl)-2-[(2R…
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) | 2.86 | 6.72 | -51.42 | 4 | 4 | 1 | 60 | 306.455 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 4.51 | -23.94 | 3 | 4 | 0 | 58 | 305.447 | 4 | ↓ |