In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 21 | Yes |
Popular Name: 2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]-ethyl-amino]acetic 2-[[(2S)-2-amino-3-(1H-indol-3-y…
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 | 5.64 | -59.47 | 4 | 6 | 0 | 104 | 289.335 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.81 | 5.34 | -53.76 | 3 | 6 | -1 | 102 | 288.327 | 6 | ↓ |