In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 21 | Yes |
Popular Name: 3-amino-N-[5-(4-butylcyclohexyl)-1,3,4-thiadiazol-2-yl]propanamide 3-amino-N-[5-(4-butylcyclohexyl)…
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) | 2.05 | 5.81 | -61.98 | 4 | 5 | 1 | 83 | 311.475 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 4.73 | -58.76 | 3 | 5 | 0 | 89 | 310.467 | 7 | ↓ |