In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 20 | No |
Popular Name: 2-(5,6-dihydro-4H-cyclopenta[d]thiazol-2-ylamino)-4,6-dimethyl-pyridine-3-carbothioamide 2-(5,6-dihydro-4H-cyclopenta[d]t…
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) | 3.62 | 7.58 | -16.17 | 3 | 4 | 0 | 64 | 304.444 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 8.13 | -31.99 | 4 | 4 | 1 | 65 | 305.452 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.