In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[ethyl(2-thienylmethyl)amino]-2-methyl-propanoic (2S)-3-[ethyl(2-thienylmethyl)am…
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) | 2.01 | 8.01 | -42.69 | 1 | 3 | 0 | 45 | 227.329 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 6.14 | -43.42 | 0 | 3 | -1 | 43 | 226.321 | 6 | ↓ |