In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | No |
Popular Name: (2S)-2-[[(2R)-3-amino-2-methyl-3-thioxo-propyl]-ethyl-amino]-N,N-diethyl-propanamide (2S)-2-[[(2R)-3-amino-2-methyl-3…
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 | 6.26 | -39.32 | 3 | 4 | 1 | 51 | 274.454 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 4.17 | -10.37 | 2 | 4 | 0 | 50 | 273.446 | 8 | ↓ |