In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 26 | Yes |
Popular Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-[(1S)-1-amino-3-methyl-butyl]thiazole-4-carboxamide N-[(1R)-1-(1-adamantyl)ethyl]-2-…
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) | 2.44 | 7.14 | -54.07 | 4 | 4 | 1 | 70 | 376.59 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 6.86 | -6.49 | 3 | 4 | 0 | 68 | 375.582 | 6 | ↓ |