In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: 2-[[(2S,3R)-2-amino-3-methyl-pentanoyl]-propyl-amino]acetic 2-[[(2S,3R)-2-amino-3-methyl-pen…
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) | -0.64 | 4.61 | -46.16 | 3 | 5 | 0 | 88 | 230.308 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 4.3 | -45.62 | 2 | 5 | -1 | 86 | 229.3 | 7 | ↓ |