In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 19 | No |
Popular Name: N-[[(3S)-1-[(2-thioxothiazolidin-3-yl)methyl]-3-piperidyl]methyl]methanesulfonamide N-[[(3S)-1-[(2-thioxothiazolidin…
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) | 1.09 | 1.67 | -20.88 | 1 | 5 | 0 | 53 | 323.509 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 4.01 | -57.3 | 2 | 5 | 1 | 54 | 324.517 | 5 | ↓ |