In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: 2-[4-[(2S)-2-amino-2-methyl-pentanoyl]piperazin-1-yl]-N-methyl-acetamide 2-[4-[(2S)-2-amino-2-methyl-pent…
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) | 0.45 | -0.25 | -45.95 | 4 | 6 | 1 | 80 | 271.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 1.48 | -97.74 | 5 | 6 | 2 | 81 | 272.393 | 5 | ↓ |