In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 16 | Yes |
Popular Name: (3S)-3-[[2-(methylamino)acetyl]amino]-3-(2-thienyl)propanoic (3S)-3-[[2-(methylamino)acetyl]a…
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) | 0.70 | 3.79 | -56.97 | 3 | 5 | 0 | 86 | 242.3 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 2.35 | -48.01 | 2 | 5 | -1 | 81 | 241.292 | 6 | ↓ |