In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2009 | 28 | Yes |
Popular Name: 2-[(1S)-1-aminopentyl]-N-[(R)-(4-chlorophenyl)-phenyl-methyl]thiazole-4-carboxamide 2-[(1S)-1-aminopentyl]-N-[(R)-(4…
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) | 3.32 | 9.21 | -56.79 | 4 | 4 | 1 | 70 | 414.982 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 8.89 | -8.93 | 3 | 4 | 0 | 68 | 413.974 | 8 | ↓ |