In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 18 | Yes |
Popular Name: (2S,3S)-2-amino-3-methyl-1-(4-propanoylpiperazin-1-yl)pentan-1-one (2S,3S)-2-amino-3-methyl-1-(4-pr…
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) | 0.24 | 3.3 | -56.55 | 3 | 5 | 1 | 68 | 256.37 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.24 | 3.03 | -12.95 | 2 | 5 | 0 | 67 | 255.362 | 4 | ↓ |