In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 18 | No |
Popular Name: (2S)-2-carbamothioyl-N-[(1S)-1-(dimethylaminomethyl)-3-methyl-butyl]butanamide (2S)-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) | 1.25 | 5.42 | -41.99 | 4 | 4 | 1 | 60 | 274.454 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.44 | 4.63 | -26.83 | 3 | 4 | 0 | 66 | 273.446 | 8 | ↓ |