In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 17 | No |
Popular Name: 2-[(4-hydroxycyclohexyl)amino]pyridine-4-carbothioamide 2-[(4-hydroxycyclohexyl)amino]py…
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) | 0.93 | 1.56 | -18.16 | 4 | 4 | 0 | 71 | 251.355 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 2.04 | -53.58 | 5 | 4 | 1 | 72 | 252.363 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.