In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 16 | No |
Popular Name: 4-[(4-isopropylpiperazin-1-yl)methyl]thiazol-2-amine 4-[(4-isopropylpiperazin-1-yl)me…
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) | 1.08 | 3.39 | -31.38 | 3 | 4 | 1 | 47 | 241.384 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 0.96 | -5.14 | 2 | 4 | 0 | 45 | 240.376 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.08 | 3.25 | -32.16 | 3 | 4 | 1 | 47 | 241.384 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | 3.53 | -76.82 | 4 | 4 | 2 | 48 | 242.392 | 3 | ↓ |