In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 18 | No |
Popular Name: (2R)-2-carbamothioyl-N-[(1S)-1-(4-pyridyl)ethyl]pentanamide (2R)-2-carbamothioyl-N-[(1S)-1-(…
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) | 0.81 | 3.91 | -8.07 | 3 | 4 | 0 | 68 | 265.382 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.81 | 4.37 | -39.63 | 4 | 4 | 1 | 69 | 266.39 | 6 | ↓ |