In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | No |
Popular Name: 2-[(1R)-1-chloroethyl]-1-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-5-methyl-benzimidazole 2-[(1R)-1-chloroethyl]-1-[[(2S)-…
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) | 3.76 | 11.34 | -39.55 | 1 | 3 | 1 | 22 | 306.861 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.76 | 9.32 | -8.57 | 0 | 3 | 0 | 21 | 305.853 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.76 | 11.8 | -86.55 | 2 | 3 | 2 | 24 | 307.869 | 4 | ↓ |