In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
Popular Name: 2-[[(2S)-3-amino-2-methyl-3-thioxo-propyl]-ethyl-amino]-N-cyclopropyl-N-methyl-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) | 0.10 | 5.62 | -41.19 | 3 | 4 | 1 | 51 | 258.411 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.10 | 3.92 | -12.4 | 2 | 4 | 0 | 50 | 257.403 | 7 | ↓ |