In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | No |
Popular Name: 2-[[(2S)-3-amino-2-methyl-3-thioxo-propyl]-methyl-amino]-N-tert-butyl-acetamide 2-[[(2S)-3-amino-2-methyl-3-thio…
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) | 0.80 | 3.72 | -41.51 | 4 | 4 | 1 | 60 | 246.4 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 1.79 | -11.57 | 3 | 4 | 0 | 58 | 245.392 | 6 | ↓ |