In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | No |
Popular Name: (2S)-N-(2-carbamothioylphenyl)-2-(4-methyl-1-piperidyl)propanamide (2S)-N-(2-carbamothioylphenyl)-2…
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) | 2.38 | 7.56 | -32.27 | 4 | 4 | 1 | 60 | 306.455 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.38 | 5.42 | -16.54 | 3 | 4 | 0 | 58 | 305.447 | 4 | ↓ |