In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2011 | 22 | No |
Popular Name: 1-[(Z)-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]methyleneamino]-3-propyl-thiourea 1-[(Z)-[2,5-dimethyl-1-(5-methyl…
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) | 3.02 | 9.5 | -17.07 | 2 | 6 | 0 | 67 | 319.434 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.