In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 27 | No |
Popular Name: 1-[4-[[(2R,6R)-2,6-dimethyl-1-piperidyl]sulfonyl]phenyl]-3-(1-piperidyl)thiourea 1-[4-[[(2R,6R)-2,6-dimethyl-1-pi…
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) | 3.14 | 8.49 | -12.01 | 2 | 6 | 0 | 65 | 410.609 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.82 | 9.53 | -27.34 | 2 | 6 | 0 | 66 | 410.609 | 5 | ↓ |