In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2011 | 17 | Yes |
Popular Name: 3-[4-(3-methyl-2-thienyl)thiazol-2-yl]pentan-3-amine 3-[4-(3-methyl-2-thienyl)thiazol…
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) | 3.63 | 5.91 | -39.64 | 3 | 2 | 1 | 41 | 267.443 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 5.7 | -4.07 | 2 | 2 | 0 | 39 | 266.435 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.